| SpectraBase Spectrum ID |
DoZ3v43nGSG |
| Name |
(E)-9-Hexadecenoic acid |
| CAS Registry Number |
2091-29-4 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
254.224580204 u |
| Formula |
C16H30O2 |
| InChI |
InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-8H,2-6,9-15H2,1H3,(H,17,18)/b8-7+ |
| InChIKey |
SECPZKHBENQXJG-BQYQJAHWSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
254.414 g/mol |
| Nominal Mass |
254 u |
| Quality |
930 |
| Retention Index |
1779 |
| SMILES |
OC(CCCCCCC\C=C\CCCCCC)=O |
| SPLASH |
splash10-05o3-9200000000-a38af51d951868c4fb0b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
9-Hexadecenoate
(E)-Hexadec-9-enoic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009313 |
