| SpectraBase Compound ID | KlgvomorX1L |
|---|---|
| InChI | InChI=1S/C8H14O3/c1-6(8(10)11-3)4-5-7(2)9/h4-7,9H,1-3H3/b5-4+ |
| InChIKey | ICCRAZAECJUAHD-SNAWJCMRSA-N |
| Mol Weight | 158.2 g/mol |
| Molecular Formula | C8H14O3 |
| Exact Mass | 158.094294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CGbgoHakVQv |
|---|---|
| Name | 3-HEXENOIC ACID, 5-HYDROXY-2-METHYL-, METHYL ESTER, [R*,R*-(E)]- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H14O3 |
| InChI | InChI=1S/C8H14O3/c1-6(8(10)11-3)4-5-7(2)9/h4-7,9H,1-3H3/b5-4+ |
| InChIKey | ICCRAZAECJUAHD-SNAWJCMRSA-N |
| Molecular Weight | 158.0939 |
| SMILES | OC(\C=C\C(C(OC)=O)C)C |
| SPLASH | splash10-052o-9100000000-e8b3d56214bc9a84388b |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |