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(Z)-3-deuterio-2-methyl-4-oxo-4-phenyl-2-butenoic acid methyl ester
SpectraBase Compound ID KBAWyYilPkm
InChI InChI=1S/C12H12O3/c1-9(12(14)15-2)8-11(13)10-6-4-3-5-7-10/h3-8H,1-2H3/b9-8-/i8D
InChIKey BFZLGHMSECAVAQ-NQHNDPCYSA-N
Mol Weight 205.23 g/mol
Molecular Formula C12H11DO3
Exact Mass 205.084921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdBVWzaN2NJ
Name (Z)-3-deuterio-2-methyl-4-oxo-4-phenyl-2-butenoic acid methyl ester
Alternate Name(s) (Z)-3-deuterio-4-keto-2-methyl-4-phenyl-but-2-enoic acid methyl ester Methyl (Z)-3-deuterio-2-methyl-4-oxidanylidene-4-phenyl-but-2-enoate Methyl (Z)-3-deuterio-2-methyl-4-oxo-4-phenyl-but-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11DO3
InChI InChI=1S/C12H12O3/c1-9(12(14)15-2)8-11(13)10-6-4-3-5-7-10/h3-8H,1-2H3/b9-8-/i8D
InChIKey BFZLGHMSECAVAQ-NQHNDPCYSA-N
Molecular Weight 205.231 g/mol
SMILES C(\C(=C/(C(=O)c1ccccc1)[D])C)(=O)OC
SPLASH splash10-0a4i-3900000000-339fc50100fb3ff672ca
Source of Spectrum SK-30-112-6
Wiley ID 881061