| SpectraBase Spectrum ID |
E1fbP2FUUsI |
| Name |
(E)-3-Methyl-2-hexen-4-ynoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H8O2 |
| InChI |
InChI=1S/C7H8O2/c1-3-4-6(2)5-7(8)9/h5H,1-2H3,(H,8,9)/b6-5+ |
| InChIKey |
ZBSHDAKWUQGJLS-AATRIKPKSA-N |
| Molecular Weight |
124.139 g/mol |
| SMILES |
OC(\C=C\(C#CC)C)=O |
| SPLASH |
splash10-00fr-4900000000-4c390b027a50eeee2471 |
| Source of Spectrum |
K-128-856-16 |
| Synonyms |
(2E)-3-methyl-2-hexen-4-ynoic acid |
| Wiley ID |
1128807 |
