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2-(4-nitrophenyl)-5-oxo-5-phenylpentanoic acid methyl ester
SpectraBase Compound ID IOqV3fDdWuN
InChI InChI=1S/C18H17NO5/c1-24-18(21)16(13-7-9-15(10-8-13)19(22)23)11-12-17(20)14-5-3-2-4-6-14/h2-10,16H,11-12H2,1H3
InChIKey GPEDJRAJSFSZDI-UHFFFAOYSA-N
Mol Weight 327.34 g/mol
Molecular Formula C18H17NO5
Exact Mass 327.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11x5u7lTcui
Name 2-(4-nitrophenyl)-5-oxo-5-phenylpentanoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO5
InChI InChI=1S/C18H17NO5/c1-24-18(21)16(13-7-9-15(10-8-13)19(22)23)11-12-17(20)14-5-3-2-4-6-14/h2-10,16H,11-12H2,1H3
InChIKey GPEDJRAJSFSZDI-UHFFFAOYSA-N
Molecular Weight 327.336 g/mol
SMILES c1(N(=O)=O)ccc(C(C(=O)OC)CCC(=O)c2ccccc2)cc1
SPLASH splash10-0axr-3940000000-6ce2bd5b840c0ef9fd42
Source of Spectrum SK-27-1458-3
Synonyms 5-keto-2-(4-nitrophenyl)-5-phenyl-valeric acid methyl ester Methyl 2-(4-nitrophenyl)-5-oxidanylidene-5-phenyl-pentanoate Methyl 2-(4-nitrophenyl)-5-oxo-5-phenyl-pentanoate
Wiley ID 867752