| SpectraBase Compound ID | BKgkAtyV0rH |
|---|---|
| InChI | InChI=1S/C7H12O4/c1-9-6(8)4-5-7(10-2)11-3/h4-5,7H,1-3H3/b5-4+ |
| InChIKey | CWHHPNNHJKOQQV-SNAWJCMRSA-N |
| Mol Weight | 160.17 g/mol |
| Molecular Formula | C7H12O4 |
| Exact Mass | 160.073559 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DKbnX9qOp3R |
|---|---|
| Name | 2-BUTENOIC ACID, 4,4-DIMETHOXY-, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H12O4 |
| InChI | InChI=1S/C7H12O4/c1-9-6(8)4-5-7(10-2)11-3/h4-5,7H,1-3H3/b5-4+ |
| InChIKey | CWHHPNNHJKOQQV-SNAWJCMRSA-N |
| Instrument Name | CH7 |
| Molecular Weight | 160.0732 |
| SMILES | COC(\C=C\C(OC)=O)OC |
| SPLASH | splash10-004i-9700000000-6b122e0d30cce89c9c76 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |