| SpectraBase Compound ID | VoU1WDxneH |
|---|---|
| InChI | InChI=1S/C7H12O5/c1-10-5(7(9)12-3)4-6(8)11-2/h5H,4H2,1-3H3 |
| InChIKey | CZGCYHISZCRQFR-UHFFFAOYSA-N |
| Mol Weight | 176.17 g/mol |
| Molecular Formula | C7H12O5 |
| Exact Mass | 176.068473 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ItEuzffs8El |
|---|---|
| Name | BUTANEDIOIC ACID, METHOXY-, DIMETHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O5 |
| InChI | InChI=1S/C7H12O5/c1-10-5(7(9)12-3)4-6(8)11-2/h5H,4H2,1-3H3 |
| InChIKey | CZGCYHISZCRQFR-UHFFFAOYSA-N |
| Molecular Weight | 176.0681 |
| SMILES | COC(CC(C(OC)=O)OC)=O |
| SPLASH | splash10-004i-9300000000-daaad37326efd5a3bb22 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |