Naphthalene, 1,2-dihydro-1,1,6-trimethyl-
- Formula: C13H16
- Molecular weight: 172.2661
- IUPAC Standard InChIKey: RTUMCNDCAVLXEP-UHFFFAOYSA-N
- CAS Registry Number: 30364-38-6
- 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: 1,1,6-Trimethyl-1,2-dihydronaphthalene; Dehydro-ar-ionene; 1,2-Dihydro-1,1,6-trimethylnaphthalene; TDN; 1,1,6-trimethyl-1,2-dihydronaphthalene (TDN); 1,1,6-Trimethyl-1,2-dihydro-naphthalene (dehydro-ar-ionene); Naphthalene, 1,2-dihydro-1,1,6-trimethyl-, (TDN)
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Normal alkane RI, non-polar column, custom temperature program
Go To: Top, 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
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | TR-5 MS | Polydimethyl siloxane with 5 % Ph groups | Polydimethyl siloxane with 5 % Ph groups | HP-5 MS | HP-5 |
Column length (m) | 15. | 30. | |||
Carrier gas | Helium | Hydrogen | |||
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | |||
Phase thickness (μm) | 0.25 | 0.25 | |||
Program | 35 0C (3 min) 2 0C/min -> 60 0C (3 min) 2 0C/min -> 80 0C (3 min) 4 0C/min -> 120 0C (3 min) 5 0C/min -> 150 0C (3 min) 15 0C/min -> 240 0C (10 min) | not specified | not specified | 50 0C (15 min) 2 0C/min -> 150 0C (10 min) 2 0C/min -> 220 0C (20 min) | not specified |
I | 1344. | 1364. | 1367. | 1398. | 1340. |
Reference | Kurashov, Mitrukova, et al., 2014 | Robinson, Adams, et al., 2012 | Robinson, Adams, et al., 2012 | Chuang, Lee, et al., 2007 | Riu-Aumatell, Lopez-Tamames, et al., 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|
Active phase | HP-5 | HP-5MS | CP Sil 5 CB | DB-1 |
Column length (m) | 30. | 30. | 25. | 60. |
Carrier gas | He | He | He | |
Substrate | ||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | |
Phase thickness (μm) | 0.25 | 0.25 | 0.39 | |
Program | 40C(1min) => 5C/min => 180C => 10C/min => 220C(2min) | 40C(1min) => 5C/min => 220C => 10C/min => 240C(2min) | not specified | not specified |
I | 1354. | 1354. | 1333. | 1329. |
Reference | Demyttenaere, Dagher, et al., 2003 | Demyttenaere, Dagher, et al., 2002 | Weyerstahl, Marschall, et al., 1998 | Buttery, Teranishi, et al., 1990 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Kurashov, Mitrukova, et al., 2014
Kurashov, E.A.; Mitrukova, G.G.; Krylova, Yu.V.,
Variations in the component composition of essential oil of Ceratophyllum demersum (Ceratophyllaceae) during vegetation (in press),
Plant Resources (Rastitel'nye Resursy), 2014, 1, 000-000. [all data]
Robinson, Adams, et al., 2012
Robinson, A.L.; Adams, D.O.; Boss, P.K.; Heymann, H.; Solomon, P.S.; Trengove, R.D.,
Influence of geographic origine on the sensory characteristics and wine composition of Vitus viniferas cv. Cabernet Sauvignon wines from Australia (Supplemental data),
Am. J. Enol. Vitic., 2012, 64, 4, 467-476, https://doi.org/10.5344/ajev.2012.12023
. [all data]
Chuang, Lee, et al., 2007
Chuang, P.-H.; Lee, C.-W.; Chou, J.-Y.; Murugan, M.; Shieh, B.-J.; Chen, H.-M.,
Anti-fungal activity of crude extracts and essential oil of Moringa oleifera Lam,
Bioresource Technol., 2007, 98, 1, 232-236, https://doi.org/10.1016/j.biortech.2005.11.003
. [all data]
Riu-Aumatell, Lopez-Tamames, et al., 2005
Riu-Aumatell, M.; Lopez-Tamames, E.; Buxaderas, S.,
Assessment of the Volatile Composition of Juices of Apricot, Peach, and Pear According to Two Pectolytic Treatments,
J. Agric. Food Chem., 2005, 53, 20, 7837-7843, https://doi.org/10.1021/jf051397z
. [all data]
Demyttenaere, Dagher, et al., 2003
Demyttenaere, J.C.R.; Dagher, C.; Sandra, P.; Kallithraka, S.; Verhé, R.; de Kimpe, N.,
Flavour analysis of Greek white wine by solid-phase microextraction-capillary gas chromatography-mass spectrometry,
J. Chromatogr. A, 2003, 985, 1-2, 233-246, https://doi.org/10.1016/S0021-9673(02)01467-X
. [all data]
Demyttenaere, Dagher, et al., 2002
Demyttenaere, J.C.R.; Dagher, C.; Verhé, R.; Sandra, P.,
Flavour analysis of Greek white wine using solid phase microextraction - capillary GC/MS
in 25th International Symposium on Capillary Chromatography, 2002, 1-16. [all data]
Weyerstahl, Marschall, et al., 1998
Weyerstahl, P.; Marschall, H.; Weirauch, M.; Thefeld, K.; Surburg, H.,
Constituents of commercial Labdanum oil,
Flavour Fragr. J., 1998, 13, 5, 295-318, https://doi.org/10.1002/(SICI)1099-1026(1998090)13:5<295::AID-FFJ751>3.0.CO;2-I
. [all data]
Buttery, Teranishi, et al., 1990
Buttery, R.G.; Teranishi, R.; Flath, R.A.; Ling, L.C.,
Identification of additional tomato paste volatiles,
J. Agric. Food Chem., 1990, 38, 3, 792-795, https://doi.org/10.1021/jf00093a042
. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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