| SpectraBase Spectrum ID |
BKemMQrGV8P |
| Name |
(2E-Hexenyl) propanoate |
| CAS Registry Number |
53398-80-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H16O2 |
| 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/C9H16O2/c1-3-5-6-7-8-11-9(10)4-2/h6-7H,3-5,8H2,1-2H3/b7-6+ |
| InChIKey |
LPWKTEHEFDVAQS-VOTSOKGWSA-N |
| Molecular Weight |
156.225 g/mol |
| SMILES |
C(OC(CC)=O)\C=C\CCC |
| SPLASH |
splash10-0a4i-9000000000-2a9cea9e30b1b214098e |
| Source |
ex BEDOUKAIN CHEM ex JJ BROPHY |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Synonyms |
Hexenyl propanoate<2E-> |
| Wiley ID |
1887498 |
