| SpectraBase Compound ID | 9EyHlgvBBte |
|---|---|
| InChI | InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h1H,3-6H2,(H,8,9) |
| InChIKey | OFCPMJGTZUVUSM-UHFFFAOYSA-N |
| Mol Weight | 126.15 g/mol |
| Molecular Formula | C7H10O2 |
| Exact Mass | 126.06808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AXPt5EpEDvE |
|---|---|
| Name | 6-Heptynoic acid |
| CAS Registry Number | 30964-00-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H10O2 |
| InChI | InChI=1S/C7H10O2/c1-2-3-4-5-6-7(8)9/h1H,3-6H2,(H,8,9) |
| InChIKey | OFCPMJGTZUVUSM-UHFFFAOYSA-N |
| Molecular Weight | 126.155 g/mol |
| SMILES | OC(CCCCC#C)=O |
| SPLASH | splash10-001i-9000000000-83a9b394bb4f8a208f6f |
| Source of Spectrum | KC-1988-3251-3 |
| Synonyms | Hept-6-ynoic acid |
| Wiley ID | 1129938 |