| SpectraBase Compound ID | 8TnuDBhqJbu |
|---|---|
| InChI | InChI=1S/C8H12O4/c1-4-3-6(10)7(5(2)9)8(11)12-4/h3,5,8-11H,1-2H3 |
| InChIKey | NDMUKZHZMHZILR-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 | 7s6YF7VylBb |
|---|---|
| Name | 2H-PYRAN-2-ONE, 3-ACETYL-4-HYDROXY-6-METHYL- |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C8H8O4 |
| InChI | InChI=1S/C8H12O4/c1-4-3-6(10)7(5(2)9)8(11)12-4/h3,5,8-11H,1-2H3 |
| InChIKey | NDMUKZHZMHZILR-UHFFFAOYSA-N |
| Molecular Weight | 172.0732 |
| SMILES | OC1C(C(C)O)=C(C=C(O1)C)O |
| SPLASH | splash10-014l-9600000000-e3ad26f3d52037e2a04a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |