| SpectraBase Compound ID | 53RVXfEUpTg |
|---|---|
| InChI | InChI=1S/C8H14O4/c1-5(2)8(3,7(11)12)4-6(9)10/h5H,4H2,1-3H3,(H,9,10)(H,11,12) |
| InChIKey | ZTPFWDMGYSWDAI-UHFFFAOYSA-N |
| Mol Weight | 174.2 g/mol |
| Molecular Formula | C8H14O4 |
| Exact Mass | 174.089209 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 20u3sFJaQ6l |
|---|---|
| Name | BUTANEDIOIC ACID, 2-METHYL-2-(1-METHYLETHYL)- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H14O4 |
| InChI | InChI=1S/C8H14O4/c1-5(2)8(3,7(11)12)4-6(9)10/h5H,4H2,1-3H3,(H,9,10)(H,11,12) |
| InChIKey | ZTPFWDMGYSWDAI-UHFFFAOYSA-N |
| Molecular Weight | 174.0888 |
| SMILES | OC(C(CC(O)=O)(C(C)C)C)=O |
| SPLASH | splash10-029l-9300000000-cd4fb19f051bb1df3ec1 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |