| SpectraBase Spectrum ID |
KFmeBEFKz2w |
| Name |
Benzoic acid, 2-[[(2,4-dimethyl-3-cyclohexen-1-yl)methylene]amino]-, methyl ester |
| CAS Registry Number |
68845-02-3 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
271.157228918 u |
| Formula |
C17H21NO2 |
| InChI |
InChI=1S/C17H21NO2/c1-12-8-9-14(13(2)10-12)11-18-16-7-5-4-6-15(16)17(19)20-3/h4-7,10-11,13-14H,8-9H2,1-3H3/b18-11+ |
| InChIKey |
GZMGSIZLVIFVKF-WOJGMQOQSA-N |
| Molecular Weight |
271.360 g/mol |
| Number of Peaks |
50 |
| RI1 |
2207 |
| RI2 |
1882 |
| RI3 |
2319 |
| RI4 |
2287 |
| RI5 |
2179 |
| SMILES |
CC1C(CCC(=C1)C)\C=N\c1c(C(=O)OC)cccc1 |
| SPLASH |
splash10-05fs-2950000000-c66e4510a694ae1cf171 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Benzoic acid, 2-[[(2,4-dimethyl-3-cyclohexen-1-yl)methylene]amino]-, methyl ester |
| Wiley ID |
LM_FFNSC3_3234 |
![Benzoic acid, 2-[[(2,4-dimethyl-3-cyclohexen-1-yl)methylene]amino]-, methyl ester](/api/spectrum/KFmeBEFKz2w/structure.png?h=300&w=458 "Benzoic acid, 2-[[(2,4-dimethyl-3-cyclohexen-1-yl)methylene]amino]-, methyl ester")
