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Methyl 4-(trans-4-(N-methylbenzamido)cyclohexyl)benzoate
SpectraBase Compound ID LK5xJZInp0H
InChI InChI=1S/C22H25NO3/c1-23(21(24)18-6-4-3-5-7-18)20-14-12-17(13-15-20)16-8-10-19(11-9-16)22(25)26-2/h3-11,17,20H,12-15H2,1-2H3/t17-,20-
InChIKey KRRPJCJGZOROJC-IRJFHVNHSA-N
Mol Weight 351.45 g/mol
Molecular Formula C22H25NO3
Exact Mass 351.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LFirGc7QN8O
Name Methyl 4-(trans-4-(N-methylbenzamido)cyclohexyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO3
InChI InChI=1S/C22H25NO3/c1-23(21(24)18-6-4-3-5-7-18)20-14-12-17(13-15-20)16-8-10-19(11-9-16)22(25)26-2/h3-11,17,20H,12-15H2,1-2H3/t17-,20-
InChIKey KRRPJCJGZOROJC-IRJFHVNHSA-N
Literature Reference DOI 10.1021/ol403673e
Molecular Weight 351.446 g/mol
SMILES [C@]1(N(C)C(=O)c2ccccc2)(CC[C@](CC1)(c1ccc(cc1)C(OC)=O)[H])[H]
SPLASH splash10-0pbi-1915000000-1f10de3faad6831886d4
Source of Spectrum A1-16-924/SM47-3ea
Synonyms Methyl 4-((1r,4r)-4-(N-methylbenzamido)cyclohexyl)benzoate
Wiley ID 1747726