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2-[(3,4-dimethoxyphenyl)carbamoyl]cyclohexane-1-carboxylic acid
SpectraBase Compound ID 3bvX2RqFfY1
InChI InChI=1S/C16H21NO5/c1-21-13-8-7-10(9-14(13)22-2)17-15(18)11-5-3-4-6-12(11)16(19)20/h7-9,11-12H,3-6H2,1-2H3,(H,17,18)(H,19,20)
InChIKey JMEMTZYJXZKPRO-UHFFFAOYSA-N
Mol Weight 307.35 g/mol
Molecular Formula C16H21NO5
Exact Mass 307.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kh34W4Ajfi2
Name 2-[(3,4-dimethoxyphenyl)carbamoyl]cyclohexane-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO5
InChI InChI=1S/C16H21NO5/c1-21-13-8-7-10(9-14(13)22-2)17-15(18)11-5-3-4-6-12(11)16(19)20/h7-9,11-12H,3-6H2,1-2H3,(H,17,18)(H,19,20)
InChIKey JMEMTZYJXZKPRO-UHFFFAOYSA-N
Molecular Weight 307.346 g/mol
SMILES OC(C1C(C(Nc2cc(OC)c(cc2)OC)=O)CCCC1)=O
SPLASH splash10-0udr-9800000000-ac2957a42de2cba8d475
Source of Spectrum IY-2-5108-8
Synonyms 2-[(3,4-dimethoxyanilino)-oxomethyl]-1-cyclohexanecarboxylic acid
Wiley ID 1659071