| SpectraBase Spectrum ID |
69D5bIHOEBP |
| Name |
3-HEXENOIC ACID, METHYL ESTER |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
128.083729624 u |
| Formula |
C7H12O2 |
| InChI |
InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h4-5H,3,6H2,1-2H3/b5-4+ |
| InChIKey |
XEAIHUDTEINXFG-SNAWJCMRSA-N |
| Molecular Weight |
128.171 g/mol |
| Nominal Mass |
128 u |
| Number of Peaks |
68 |
| SMILES |
C(\C=C\CC)C(OC)=O |
| SPLASH |
splash10-01bc-9000000000-55e6a9381c6a1c490e86 |
| Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Wiley ID |
MVX000803 |
