Tricyclo[2.2.1.0(2,6)]heptane, 1,7-dimethyl-7-(4-methyl-3-pentenyl)-, (-)-
- Formula: C15H24
- Molecular weight: 204.3511
- IUPAC Standard InChI: InChI=1S/C15H24/c1-10(2)6-5-7-14(3)11-8-12-13(9-11)15(12,14)4/h6,11-13H,5,7-9H2,1-4H3
- IUPAC Standard InChIKey: KWFJIXPIFLVMPM-UHFFFAOYSA-N
- CAS Registry Number: 512-61-8
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: α-Santalene; (-)-α-Santalene; Santalen; Santalene; 1,7-Dimethyl-7-(4-methyl-3-pentenyl)-tricyclo[2.2.1.0(2,6)]heptane, (-)-; 1,7-Dimethyl-7-(4-methyl-3-pentenyl)tricyclo[2.2.1.0(2.6)]heptane; 1,7-Dimethyl-7-(4-methyl-3-pentenyl)-tricyclo[2.2.1.0(2,6)]heptane
- Permanent link for this species. Use this link for bookmarking this species for future reference.
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Mass spectrum (electron ionization)
Go To: Top, Gas Chromatography, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
View image of digitized spectrum (can be printed in landscape orientation).
Due to licensing restrictions, this spectrum cannot be downloaded.
| Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
|---|---|
| NIST MS number | 9254 |
Gas Chromatography
Go To: Top, Mass spectrum (electron ionization), References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Kovats' RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-5MS | 1420. | Siani, Garrido, et al., 2004 | 30. m/0.32 mm/0.25 μm, He, 70. C @ 5. min, 3. K/min; Tend: 250. C |
| Capillary | DB-5 | 1418. | Viña and Murillo, 2003 | 30. m/0.25 mm/0.25 μm, He, 50. C @ 5. min, 0.5 K/min, 250. C @ 10. min |
Van Den Dool and Kratz RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | SPB-1 | 1410. | Blagojevic, Radulovic, et al., 2006 | 30. m/0.25 mm/0.25 μm, He, 50. C @ 3. min, 5. K/min, 250. C @ 15. min |
| Capillary | DB-5 | 1424. | Blagojevic, Radulovic, et al., 2006 | 30. m/0.2 mm/0.25 μm, He, 50. C @ 3. min, 5. K/min, 250. C @ 15. min |
| Capillary | DB-5 | 1420. | Masoudi, Esmaeili, et al., 2006 | 50. m/0.2 mm/0.32 μm, N2, 60. C @ 3. min, 5. K/min, 220. C @ 5. min |
| Capillary | DB-5 | 1417. | bin Jantan, Yalvema, et al., 2005 | 25. m/0.25 mm/0.25 μm, N2, 75. C @ 10. min, 3. K/min, 210. C @ 1. min |
| Capillary | BPX-5 | 1420. | bin Ahmad and bin Jantan, 2003 | 30. m/0.25 mm/0.25 μm, N2, 75. C @ 10. min, 3. K/min, 210. C @ 1. min |
| Capillary | Optima 5 | 1410. | Chosson, Vérité, et al., 2003 | 25. m/0.25 mm/0.25 μm, He, 3. K/min, 280. C @ 20. min; Tstart: 60. C |
| Capillary | RTX-5 | 1417. | Mondello, Zappia, et al., 2002 | 30. m/0.25 mm/0.25 μm, He, 45. C @ 6. min, 3. K/min, 300. C @ 10. min |
| Capillary | DB-5 | 1420. | Isidorov, Zenkevich, et al., 2001 | He, 3. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 250. C |
| Capillary | OV-1 | 1452. | De Pooter, Omar, et al., 1985 | 30. m/0.5 mm/0.8 μm, He, 2. K/min; Tstart: 40. C; Tend: 220. C |
Van Den Dool and Kratz RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-5MS | 1424.2 | Andriamaharavo, 2014 | 30. m/0.25 mm/0.25 μm, He; Program: 60C (1 min) => 5 C/min => 210C => 10 C/min => 280C (15 min) |
| Capillary | BPX-5 | 1431. | Cardeal, da Silva, et al., 2006 | 30. m/0.25 mm/0.25 μm; Program: 35C(5min) => 3C/min => 210C => 40C/min => 240C (4min) |
| Capillary | BPX-5 | 1449. | Elmore, Erbahadir, et al., 1997 | 50. m/0.32 mm/0.5 μm, He; Program: 0C (5min) => 40C/min => 40C (2min) => 10C/min => 280C |
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | ZB-5 MS | 1447. | Boix, Victorio, et al., 2010 | 30. m/0.25 mm/0.25 μm, Helium, 5. K/min; Tstart: 60. C; Tend: 290. C |
| Capillary | RTX-1 | 1422. | Dib, Djabou, et al., 2010 | 60. m/0.22 mm/0.25 μm, Helium, 2. K/min, 230. C @ 30. min; Tstart: 60. C |
| Capillary | DB-5 | 1419. | Magalhaes, Lima, et al., 2010 | 30. m/0.25 mm/0.25 μm, Helium, 3. K/min; Tstart: 60. C; Tend: 240. C |
| Capillary | HP-5 MS | 1427. | Sahraoui, Vian, et al., 2008 | 30. m/0.25 mm/0.25 μm, Helium, 60. C @ 8. min, 2. K/min, 250. C @ 15. min |
| Capillary | DB-5MS | 1421. | Maronigiu, Piras, et al., 2006 | 30. m/0.25 mm/0.25 μm, He, 3. K/min, 280. C @ 30. min; Tstart: 60. C |
| Capillary | DB-1 | 1428. | Fakhari, Salehi, et al., 2005 | 60. m/0.25 mm/0.25 μm, He, 5. K/min; Tstart: 60. C; Tend: 250. C |
| Capillary | DB-5 | 1418. | Morteza-Semnani and Saeedi, 2005 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 4. min, 4. K/min; Tend: 220. C |
| Capillary | Methyl Silicone | 1428. | Ricci, Fraternale, et al., 2005 | 12.5 m/0.25 mm/0.25 μm, He, 4. K/min; Tstart: 50. C; Tend: 270. C |
| Capillary | ZB-5 | 1440. | Jürgens and Dötterl, 2004 | 60. m/0.25 mm/0.25 μm, He, 40. C @ 4.6 min, 6. K/min, 260. C @ 1. min |
| Capillary | DB-1 | 1414. | Palá-Paúl, Velasco-Negueruela, et al., 2004 | 50. m/0.25 mm/0.25 μm, N2, 4. K/min; Tstart: 95. C; Tend: 240. C |
| Capillary | Methyl Silicone | 1435. | Curini, Bianchi, et al., 2003 | He, 4. K/min; Column length: 12.5 m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 270. C |
| Capillary | HP-1 | 1424. | Fekam Boyom, Amvam Zollo, et al., 2003 | 30. m/0.25 mm/0.25 μm, He, 10. K/min; Tstart: 70. C; Tend: 200. C |
| Capillary | Optima-5 | 1421. | Jacquemond-Collet, Bessière, et al., 2001 | He, 50. C @ 3. min, 3. K/min; Column length: 30. m; Column diameter: 0.2 mm; Tend: 250. C |
| Capillary | CBP-1 | 1412. | Ly, Yamauchi, et al., 2001 | 25. m/0.25 mm/0.25 μm, Nitrogen, 50. C @ 2. min, 3. K/min; Tend: 210. C |
| Capillary | DB-1 | 1428. | Bailac, Dellacasa, et al., 2000 | 60. m/0.25 mm/0.25 μm, N2, 60. C @ 5. min, 3. K/min, 220. C @ 22. min |
| Capillary | DB-1 | 1432. | Feger, Brandauer, et al., 2000 | 33. m/0.25 mm/0.50 μm, N2, 50. C @ 2. min, 20. K/min; Tend: 135. C |
| Capillary | CP Sil 5 CB | 1405. | Asekun and Ekundayo, 1999 | 25. m/0.25 mm/0.15 μm, H2, 3. K/min; Tstart: 50. C; Tend: 320. C |
| Capillary | OV-101 | 1405. | Kuiate, Zollo, et al., 1999 | 5. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 50. C; Tend: 200. C |
| Capillary | OV-1 | 1407. | Oberhofer, Nikiforov, et al., 1999 | 25. m/0.25 mm/0.25 μm, H2, 40. C @ 5. min, 3. K/min, 220. C @ 5. min |
| Capillary | CP Sil 5 CB | 1409. | Bos, Woerdenbag, et al., 1997 | 25. m/0.32 mm/0.25 μm, N2, 4. K/min; Tstart: 50. C; Tend: 290. C |
| Capillary | CP Sil 5 CB | 1409. | Bos, Woerdenbag, et al., 1997 | 25. m/0.32 mm/0.25 μm, N2, 4. K/min; Tstart: 50. C; Tend: 290. C |
| Capillary | DB-5 | 1424. | Elias, Simoneit, et al., 1997 | 30. m/0.25 mm/0.25 μm, He, 65. C @ 2. min, 4. K/min; Tend: 300. C |
| Capillary | SE-30 | 1412. | Ramaswami, Briscese, et al., 1988 | 50. C @ 2. min, 4. K/min, 240. C @ 10. min; Column length: 30. m |
| Capillary | SE-30 | 1412. | Ramaswami, Briscese, et al., 1986 | 50. C @ 2. min, 4. K/min, 240. C @ 10. min; Column length: 30. m |
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | 5 % Phenyl polydimethyl siloxane | 1418. | Chaverri, Diaz, et al., 2011 | Program: not specified |
| Capillary | RTX-1 | 1415. | Dib, Djabou, et al., 2010 | 60. m/0.22 mm/0.25 μm, Helium; Program: not specified |
| Capillary | DB-5 | 1423. | Courtois, Paine, et al., 2009 | 30. m/0.25 mm/0.25 μm, Helium; Program: 50 0C m6 0C/min -> 140 0C 5 0C/min -> 160 0C (1 min) 10 0C/min -> 200 0C |
| Capillary | SPB-5 | 1414. | Chemat, Lucchesi, et al., 2006 | 60. m/0.32 mm/1. μm, He; Program: 60C => 1C/min => 130C => 2C/min => 200C => 4C/min => 250C (40min) |
| Capillary | SPB-5 | 1414. | Iriti, Colnaghi, et al., 2006 | 60. m/0.32 mm/1. μm, He; Program: 60C => 1C/min => 130C => 2C/min => 200C => 4C/min => 250C(40min) |
| Capillary | SE-52 | 1418. | Tognolini, Barocelli, et al., 2006 | 30. m/0.32 mm/0.15 μm, He; Program: 45C => 1C/min => 100C => 5C/min => 250C (10min) |
| Capillary | SE-30 | 1412. | Vinogradov, 2004 | Program: not specified |
| Capillary | SE-30 | 1470. | Li, Wu, et al., 2002 | He; Column length: 60. m; Column diameter: 0.25 mm; Program: 50 0C (5 min) 5 0C/min -> 165 0C 4 0C/min -> 230 0C |
| Capillary | DB-5 | 1420. | Isidorov, Zenkevich, et al., 2001 | He; Column length: 30. m; Column diameter: 0.25 mm; Program: not specified |
| Capillary | CBP-1 | 1412. | Ly, Yamauchi, et al., 2001 | 25. m/0.25 mm/0.25 μm, Nitrogen; Program: not specified |
| Capillary | Methyl Silicone | 1412. | Zenkevich, 1996 | Program: not specified |
Normal alkane RI, polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | RTX-Wax | 1569. | Dib, Djabou, et al., 2010 | 60. m/0.22 mm/0.25 μm, Helium, 2. K/min, 230. C @ 30. min; Tstart: 60. C |
| Capillary | Innowax FSC | 1566. | Lourens, Reddy, et al., 2004 | Helium, 60. C @ 10. min, 4. K/min; Column length: 60. m; Column diameter: 0.25 mm; Tend: 220. C |
| Capillary | DB-Wax | 1597. | Sawamura, Son, et al., 2004 | 60. m/0.25 mm/0.25 μm, 70. C @ 2. min, 2. K/min, 230. C @ 20. min |
| Capillary | DB-Wax | 1597. | Sawamura, Sou, et al., 2004 | 60. m/0.25 mm/0.25 μm, Nitrogen, 70. C @ 2. min, 2. K/min; Tend: 230. C |
| Capillary | RTX-Wax | 1601. | Galindo-Cuspinera, Lubran, et al., 2002 | 60. m/0.25 mm/0.5 μm, He, 40. C @ 5. min, 5. K/min, 180. C @ 20. min |
| Capillary | DB-Wax | 1555. | Hatsuko, Kazuko, et al., 1992 | He, 60. C @ 10. min, 3. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tend: 240. C |
| Capillary | Supelcowax-10 | 1574. | Ramaswami, Briscese, et al., 1988 | 50. C @ 2. min, 4. K/min, 240. C @ 10. min; Column length: 30. m |
| Capillary | Supelcowax-10 | 1574. | Ramaswami, Briscese, et al., 1986 | He, 50. C @ 2. min, 4. K/min, 240. C @ 10. min; Column length: 30. m |
Normal alkane RI, polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | Carbowax 20M | 1574. | Vinogradov, 2004 | Program: not specified |
| Capillary | Innowax FSC | 1583. | Baser, Demirci, et al., 2003 | 60. m/0.25 mm/0.25 μm, He; Program: 60C(10min) => 4C/min => 220C (10min) => 1C/min => 240C |
| Capillary | FFAP | 1576. | Tucker, Maciarello, et al., 2001 | 50. m/0.2 mm/0.33 μm; Program: 60C(1min) => 2.5C/min => 115C => 1C/min => 210C(30min) |
| Capillary | Polyethylene Glycol | 1608. | Vernin, Metzger, et al., 1990 | Program: not specified |
References
Go To: Top, Mass spectrum (electron ionization), Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Siani, Garrido, et al., 2004
Siani, A.C.; Garrido, I.S.; Monteiro, S.S.; Carvalho, E.S.; Ramos, M.F.S.,
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Notes
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