SpectraBase Compound ID | FVK5ZkaPcHk |
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InChI | InChI=1S/C12H11ClO3/c13-10-3-1-2-9(8-10)4-5-11(14)6-7-12(15)16/h1-5,8H,6-7H2,(H,15,16)/b5-4+ |
InChIKey | YXCDTLPGWMACRW-SNAWJCMRSA-N |
Mol Weight | 238.67 g/mol |
Molecular Formula | C12H11ClO3 |
Exact Mass | 238.039672 g/mol |
SpectraBase Spectrum ID | DAdGT4oSJVu |
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Name | trans-6-(m-CHLOROPHENYL)-4-OXO-5-HEXENOIC ACID |
Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H11ClO3 |
InChI | InChI=1S/C12H11ClO3/c13-10-3-1-2-9(8-10)4-5-11(14)6-7-12(15)16/h1-5,8H,6-7H2,(H,15,16)/b5-4+ |
InChIKey | YXCDTLPGWMACRW-SNAWJCMRSA-N |
Instrument Name | BRUKER AC-300 |
Molecular Weight | 238.67 |
Solvent | DMSO-d6; Reference=TMS; Temperature 297K |