Eugenol, β-D-glucopyranoside, TFA
- Formula: C24H18F12O11
- Molecular weight: 710.3740
- IUPAC Standard InChI: InChI=1S/C24H18F12O11/c1-3-4-9-5-6-10(11(7-9)41-2)43-16-15(47-20(40)24(34,35)36)14(46-19(39)23(31,32)33)13(45-18(38)22(28,29)30)12(44-16)8-42-17(37)21(25,26)27/h3,5-7,12-16H,1,4,8H2,2H3/t12-,13-,14+,15-,16-/m0/s1
- IUPAC Standard InChIKey: OXPQPWKLKWTOPR-QMHWVQJVSA-N
- 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: Eugenol, Gly, TFA
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Van Den Dool and Kratz 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 |
|---|---|---|---|
| Active phase | DB-5MS | DB-5MS | DB-5 |
| Column length (m) | 30. | 30. | 30. |
| Carrier gas | He | He | H2 |
| Substrate | |||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | |
| Program | 125C => 3C/min => 220C => 2C/min => 280C | 125C => 3C/min => 220C => 2C/min => 280C | not specified |
| I | 2032. | 2039. | 2039. |
| Reference | Chassagne, Crouzet, et al., 1998 | Chassagne, Crouzet, et al., 1998 | Sakho, Chassagne, et al., 1997 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz 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.
Chassagne, Crouzet, et al., 1998
Chassagne, D.; Crouzet, J.; Bayonove, C.L.; Baumes, R.L.,
Identification of passion fruit glycosides by gas chromatography/mass spectrometry,
J. Agric. Food Chem., 1998, 46, 10, 4352-4357, https://doi.org/10.1021/jf980416k
. [all data]
Sakho, Chassagne, et al., 1997
Sakho, M.; Chassagne, D.; Crouzet, J.,
African mango glycosidically bound volatile compounds,
J. Agric. Food Chem., 1997, 45, 3, 883-888, https://doi.org/10.1021/jf960277b
. [all data]
Notes
Go To: Top, Van Den Dool and Kratz RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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