| SpectraBase Spectrum ID |
4NY5jUsva68 |
| Name |
(3E)-Hexenoic acid |
| CAS Registry Number |
1577-18-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H10O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h3-4H,2,5H2,1H3,(H,7,8)/b4-3+ |
| InChIKey |
XXHDAWYDNSXJQM-ONEGZZNKSA-N |
| Molecular Weight |
114.144 g/mol |
| SMILES |
OC(C\C=C\CC)=O |
| SPLASH |
splash10-07bf-9000000000-2ae3d101a18bad210601 |
| Source |
ex BEDOUKIAN ex JJ BROPHY |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Synonyms |
Hexenoic acid<3E-> |
| Wiley ID |
1887478 |
