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4-[N-(benzenesulfonyl)cyclohexaneamido]-3-methylphenyl cyclohexanecarboxylate
SpectraBase Compound ID 5kxBCXURSpd
InChI InChI=1S/C27H33NO5S/c1-20-19-23(33-27(30)22-13-7-3-8-14-22)17-18-25(20)28(26(29)21-11-5-2-6-12-21)34(31,32)24-15-9-4-10-16-24/h4,9-10,15-19,21-22H,2-3,5-8,11-14H2,1H3
InChIKey RAHZYZISLVODFF-UHFFFAOYSA-N
Mol Weight 483.6 g/mol
Molecular Formula C27H33NO5S
Exact Mass 483.207944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jbi3cfVF1mI
Name 4-[N-(benzenesulfonyl)cyclohexaneamido]-3-methylphenyl cyclohexanecarboxylate
Alternate Name(s) Cyclohexanecarboxylic acid, 4-[(cyclohexylcarbonyl)(phenylsulfonyl)amino]-3-methylphenyl ester cyclohexanecarboxylic acid [4-[benzenesulfonyl-[cyclohexyl(oxo)methyl]amino]-3-methylphenyl] ester [4-[benzenesulfonyl(cyclohexanecarbonyl)amino]-3-methylphenyl] cyclohexanecarboxylate [4-[benzenesulfonyl(cyclohexanecarbonyl)amino]-3-methyl-phenyl] cyclohexanecarboxylate [4-[cyclohexylcarbonyl(phenylsulfonyl)amino]-3-methyl-phenyl] cyclohexanecarboxylate
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Formula C27H33NO5S
InChI InChI=1S/C27H33NO5S/c1-20-19-23(33-27(30)22-13-7-3-8-14-22)17-18-25(20)28(26(29)21-11-5-2-6-12-21)34(31,32)24-15-9-4-10-16-24/h4,9-10,15-19,21-22H,2-3,5-8,11-14H2,1H3
InChIKey RAHZYZISLVODFF-UHFFFAOYSA-N
Molecular Weight 483.623 g/mol
SMILES c1ccc(S(N(C(=O)C2CCCCC2)c2c(cc(OC(=O)C3CCCCC3)cc2)C)(=O)=O)cc1
SPLASH splash10-01x0-9530000000-c24447760479579f1f90
Source of Spectrum IY-2-4951-6
Wiley ID 1657499