| SpectraBase Compound ID | Boxy0pgmWeS |
|---|---|
| InChI | InChI=1S/C8H12O4/c1-11-8(10)5-6-3-2-4-7(9)12-6/h6H,2-5H2,1H3 |
| InChIKey | YMNCHKAIZFREFP-UHFFFAOYSA-N |
| Mol Weight | 172.18 g/mol |
| Molecular Formula | C8H12O4 |
| Exact Mass | 172.073559 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Gfpn10JTEMz |
|---|---|
| Name | 2-OXOTETRAHYDROPYRANYL-6-ACETIC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12O4 |
| InChI | InChI=1S/C8H12O4/c1-11-8(10)5-6-3-2-4-7(9)12-6/h6H,2-5H2,1H3 |
| InChIKey | YMNCHKAIZFREFP-UHFFFAOYSA-N |
| Molecular Weight | 172.0732 |
| SMILES | C1(OC(CCC1)CC(OC)=O)=O |
| SPLASH | splash10-0006-9100000000-6d610a81407d7551cbad |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |