| SpectraBase Compound ID | A58pPCCxqmv |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-4-5-7(8)9-6(2)3/h4-6H,1-3H3/b5-4+ |
| InChIKey | AABBHSMFGKYLKE-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 | B6xWiR2l5Rr |
|---|---|
| Name | CROTONIC ACID, ISOPROPYL ESTER, trans |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-4-5-7(8)9-6(2)3/h4-6H,1-3H3/b5-4+ |
| InChIKey | AABBHSMFGKYLKE-SNAWJCMRSA-N |
| Instrument Name | CH5 |
| Molecular Weight | 128.0834 |
| SMILES | C\C=C\C(OC(C)C)=O |
| SPLASH | splash10-014u-9000000000-65553186eabc24d40fe1 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |