| SpectraBase Compound ID | 5T0S5CT5g0b |
|---|---|
| InChI | InChI=1S/C6H12O3/c1-6(2,8)4-5(7)9-3/h8H,4H2,1-3H3 |
| InChIKey | JNURPEZKOSMRMZ-UHFFFAOYSA-N |
| Mol Weight | 132.16 g/mol |
| Molecular Formula | C6H12O3 |
| Exact Mass | 132.078644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9wRs5JeDgvs |
|---|---|
| Name | BUTYRIC ACID, 3-HYDROXY-3-METHYL-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H12O3 |
| InChI | InChI=1S/C6H12O3/c1-6(2,8)4-5(7)9-3/h8H,4H2,1-3H3 |
| InChIKey | JNURPEZKOSMRMZ-UHFFFAOYSA-N |
| Molecular Weight | 132.0783 |
| SMILES | OC(CC(OC)=O)(C)C |
| SPLASH | splash10-052f-9000000000-de42bb3ac430a31f77ea |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |