1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (E)-
- Formula: C15H26O
- Molecular weight: 222.3663
- IUPAC Standard InChI: InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11+
- IUPAC Standard InChIKey: FQTLCLSUCSAZDY-SDNWHVSQSA-N
- CAS Registry Number: 40716-66-3
- 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. - Species with the same structure:
- Stereoisomers:
- Other names: (.+/-.)-trans-Nerolidol; (6E)-Nerolidol; E-Nerolidol; Nerolidol, E-; Nerolidol, trans; trans-Nerolidol; trans-3,7,11-Trimethyl-dodeca-1,6,10-trien-3-ol; 3,7,11-Trimethyl-1,6,10-dodecatrien-3-ol, (E)-; α-Nerolidol; trans-β-Nerolidol; Trans-(E)-Nerolidol; (E)-3,7,11-Trimethyldodeca-1,6,10-trien-3-ol
- Information on this page:
- Other data available:
- Options:
Van Den Dool and Kratz RI, polar column, temperature ramp
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 | BP-20 | HP-Innowax | HP-Innowax | ZB-Wax | BP-20 |
| Column length (m) | 50. | 30. | 30. | 30. | 50. |
| Carrier gas | He | He | He | He | |
| Substrate | |||||
| Column diameter (mm) | 0.22 | 0.25 | 0.25 | 0.32 | 0.22 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.5 | 0.25 | 0.25 |
| Tstart (C) | 60. | 60. | 60. | 40. | 60. |
| Tend (C) | 220. | 280. | 260. | 250. | 220. |
| Heat rate (K/min) | 2. | 3. | 3. | 5. | 2. |
| Initial hold (min) | 2. | ||||
| Final hold (min) | 20. | 5. | 20. | ||
| I | 2041. | 2051. | 2053. | 2033. | 2043. |
| Reference | Boti, Koukoua, et al., 2007 | Kundakovic, Fokialakis, et al., 2007 | Saroglou, Marin, et al., 2007 | Wu, Zorn, et al., 2007 | Blanc, Bradesi, et al., 2006 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | BP-20 | RTX-Wax | HP-Wax | BP-20 | DB-Wax |
| Column length (m) | 50. | 60. | 30. | 50. | 30. |
| Carrier gas | He | He | N2 | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.22 | 0.22 | 0.25 | 0.22 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 60. | 60. | 60. | 60. | 50. |
| Tend (C) | 220. | 230. | 220. | 220. | 220. |
| Heat rate (K/min) | 2. | 2. | 5. | 2. | 4. |
| Initial hold (min) | 10. | 4. | |||
| Final hold (min) | 20. | 45. | 20. | 20. | |
| I | 2033. | 2029. | 2006. | 2038. | 2017. |
| Reference | Boti, Bighelli, et al., 2006 | Cavalli, Tomi, et al., 2006 | Flamini, Tebano, et al., 2006 | Gonny, Cavaleiro, et al., 2006 | Osorio, Alarcon, et al., 2006 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | RTX-Wax | PEG-20M | BP-20 | DB-Wax | DB-Wax |
| Column length (m) | 60. | 25. | 50. | 60. | 30. |
| Carrier gas | He | He | He | N2 | He |
| Substrate | |||||
| Column diameter (mm) | 0.22 | 0.25 | 0.22 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.3 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 60. | 50. | 60. | 70. | 40. |
| Tend (C) | 230. | 220. | 220. | 230. | 250. |
| Heat rate (K/min) | 2. | 3. | 2. | 2. | 3. |
| Initial hold (min) | 1. | 2. | |||
| Final hold (min) | 35. | 5. | 20. | 20. | 20. |
| I | 1991. | 2046. | 2039. | 2054. | 2028. |
| Reference | Paolini J., Desjobert J.M., et al., 2006 | Rubiolo P., Matteodo M., et al., 2006 | Boti J.B., Koukoua G., et al., 2005 | Choi, 2005 | Fanciullino, Gancel, et al., 2005 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | BP-20 | DB-Wax | RTX-Wax | DB-Wax | HP-Wax |
| Column length (m) | 50. | 30. | 60. | 60. | 30. |
| Carrier gas | He | He | He | He | N2 |
| Substrate | |||||
| Column diameter (mm) | 0.22 | 0.25 | 0.22 | 0.32 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 60. | 40. | 60. | 32. | 60. |
| Tend (C) | 220. | 250. | 230. | 220. | 220. |
| Heat rate (K/min) | 2. | 3. | 2. | 3. | 5. |
| Initial hold (min) | 10. | ||||
| Final hold (min) | 20. | 20. | 35. | ||
| I | 2037. | 2026. | 2013. | 2045. | 2045. |
| Reference | Ferrari, Tomi, et al., 2005 | Gancel, Ollitrault, et al., 2005 | Paolini, Costa, et al., 2005 | Brophy, Goldsack, et al., 2004 | Flamini, Luigi Cioni, et al., 2004 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | BP-20 | DB-Wax | HP-Wax | HP-Wax | RTX-Wax |
| Column length (m) | 50. | 30. | 30. | 30. | 60. |
| Carrier gas | He | He | N2 | N2 | He |
| Substrate | |||||
| Column diameter (mm) | 0.22 | 0.25 | 0.25 | 0.25 | 0.22 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 60. | 40. | 60. | 60. | 60. |
| Tend (C) | 220. | 200. | 220. | 220. | 230. |
| Heat rate (K/min) | 2. | 4. | 5. | 5. | 2. |
| Initial hold (min) | 5. | 10. | 10. | ||
| Final hold (min) | 20. | 20. | 45. | ||
| I | 2032. | 2016. | 2045. | 1997. | 2031. |
| Reference | Tam, Thuam, et al., 2004 | Yu, Kim, et al., 2004 | Bader, Caponi, et al., 2003 | Campeol, Flamini, et al., 2003 | Cavalli, Tomi, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-Wax | DB-Wax | DB-Wax | HP-Innowax | DB-Wax |
| Column length (m) | 60. | 60. | 60. | 30. | 60. |
| Carrier gas | N2 | H2 | N2 | He | N2 |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.5 | 0.25 |
| Tstart (C) | 70. | 40. | 40. | 60. | 70. |
| Tend (C) | 230. | 245. | 210. | 260. | 230. |
| Heat rate (K/min) | 2. | 1.5 | 2. | 3. | 2. |
| Initial hold (min) | 2. | ||||
| Final hold (min) | 20. | 20. | 40. | 20. | |
| I | 2054. | 2026. | 2027. | 2053. | 2040. |
| Reference | Choi, 2003 | Gancel, Ollitrault, et al., 2003 | Mau, Ko, et al., 2003 | Skaltsa, Demetzos, et al., 2003 | Choi, Kim. M.-S.L., et al., 2002 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | Innowax | RTX-Wax | AT-Wax | BP-20 | AT-Wax |
| Column length (m) | 30. | 30. | 60. | 50. | 60. |
| Carrier gas | He | He | He | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.22 | 0.32 |
| Phase thickness (μm) | 0.5 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 60. | 45. | 65. | 60. | 65. |
| Tend (C) | 260. | 250. | 250. | 220. | 250. |
| Heat rate (K/min) | 3. | 3. | 2. | 2. | 2. |
| Initial hold (min) | 6. | 10. | 10. | ||
| Final hold (min) | 10. | 10. | 60. | 60. | |
| I | 1998. | 2020. | 2015. | 2031. | 2008. |
| Reference | Couladis, Chinou, et al., 2002 | Mondello, Zappia, et al., 2002 | Pino, Marbot, et al., 2002 | Lota, Serra, et al., 2001 | Pino and Marbot, 2001 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | AT-Wax | DB-Wax | CP-Wax 52CB | DB-Wax | BP-20 |
| Column length (m) | 60. | 60. | 25. | 60. | 50. |
| Carrier gas | He | He | N2 | He | |
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.53 | 0.25 | 0.25 | 0.22 |
| Phase thickness (μm) | 0.25 | 1.0 | 0.15 | 0.25 | 0.25 |
| Tstart (C) | 65. | 50. | 40. | 70. | 60. |
| Tend (C) | 250. | 220. | 220. | 230. | 230. |
| Heat rate (K/min) | 2. | 3. | 3. | 2. | 2. |
| Initial hold (min) | 10. | 5. | 2. | ||
| Final hold (min) | 60. | 20. | 35. | ||
| I | 2015. | 2049. | 2064. | 2050. | 2031. |
| Reference | Pino, Marbot, et al., 2001 | Brophy, Goldsack, et al., 2000 | Chagonda, Makanda, et al., 2000 | Choi and Sawamura, 2000 | Lota, de Rocca Serra, et al., 2000 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-Wax | DB-Wax | BP-20 | BP-20 | Innowax |
| Column length (m) | 60. | 60. | 50. | 50. | 60. |
| Carrier gas | He | He | He | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.53 | 0.53 | 0.22 | 0.22 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | ||
| Tstart (C) | 50. | 50. | 60. | 60. | 50. |
| Tend (C) | 220. | 220. | 230. | 230. | 180. |
| Heat rate (K/min) | 3. | 3. | 2. | 2. | 2.5 |
| Initial hold (min) | 5. | ||||
| Final hold (min) | 35. | 35. | |||
| I | 2049. | 2049. | 2031. | 2031. | 2008. |
| Reference | Brophy, Goldsack, et al., 1999 | Brophy, Goldsack, et al., 1999, 2 | Lota, Serra, et al., 1999 | Lota, Serra, et al., 1999 | Stashenko, Cervantes, et al., 1999 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | Carbowax 20M | DB-Wax | DB-Wax | Carbowax 20M | BP-20 |
| Column length (m) | 25. | 60. | 60. | 25. | 50. |
| Carrier gas | H2 | He | He | He | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.32 | 0.25 | 0.22 |
| Phase thickness (μm) | 0.3 | 0.3 | 0.25 | ||
| Tstart (C) | 50. | 35. | 35. | 50. | 60. |
| Tend (C) | 200. | 220. | 220. | 200. | 230. |
| Heat rate (K/min) | 3. | 3. | 3. | 3. | 2. |
| Initial hold (min) | 1. | 1. | |||
| Final hold (min) | 20. | 20. | 35. | ||
| I | 2048. | 2040. | 2049. | 2046. | 2031. |
| Reference | Bicchi, Rubiolo, et al., 1998 | Brophy, Forster, et al., 1998 | Brophy, Goldsack, et al., 1998 | Bicchi, Fresia, et al., 1997 | Mariotti, Costa, et al., 1997 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary |
|---|---|---|---|
| Active phase | Carbowax 20M | HP-20M | HP-FFAP |
| Column length (m) | 60. | 50. | 50. |
| Carrier gas | He | He | He |
| Substrate | |||
| Column diameter (mm) | 0.32 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.425 | ||
| Tstart (C) | 45. | 60. | 60. |
| Tend (C) | 300. | 190. | 210. |
| Heat rate (K/min) | 3. | 3. | 3. |
| Initial hold (min) | 3. | ||
| Final hold (min) | 20. | ||
| I | 2025. | 2009. | 2055. |
| Reference | Mondello, Dugo, et al., 1995 | Chung, Eiserich, et al., 1993 | Chung, Eiserich, et al., 1993 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz RI, polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Boti, Koukoua, et al., 2007
Boti, J.B.; Koukoua, G.; N'Guessan, T.Y.; Casanova, J.,
Chemical variability of Conyza sumatrensis and Microglossa pyrifolia from Côte d'Ivoire,
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Notes
Go To: Top, Van Den Dool and Kratz RI, polar column, temperature ramp, References
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