| SpectraBase Compound ID | Aw7lakni9Dr |
|---|---|
| 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 |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8ethvRCByan |
|---|---|
| Name | 3-HEXENOIC ACID, METHYL ESTER, (E)- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| 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 |
| Instrument Name | CH7 |
| Molecular Weight | 128.0834 |
| SMILES | CC\C=C\CC(OC)=O |
| SPLASH | splash10-00kf-9000000000-5dcba463159c06c29699 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |