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cis (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 1-benzyl-3-methyl-4-oxoazetidine-2-carboxylate
SpectraBase Compound ID HWZckMUzdk4
InChI InChI=1S/C22H31NO3/c1-14(2)18-11-10-15(3)12-19(18)26-22(25)20-16(4)21(24)23(20)13-17-8-6-5-7-9-17/h5-9,14-16,18-20H,10-13H2,1-4H3/t15-,16?,18+,19-,20?/m1/s1
InChIKey XVRULJYFWVYJEH-GJLSOYBTSA-N
Mol Weight 357.49 g/mol
Molecular Formula C22H31NO3
Exact Mass 357.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9RIPNzOBTRB
Name cis (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 1-benzyl-3-methyl-4-oxoazetidine-2-carboxylate
Alternate Name(s) (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 1-benzyl-3-methyl-4-oxoazetidine-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31NO3
InChI InChI=1S/C22H31NO3/c1-14(2)18-11-10-15(3)12-19(18)26-22(25)20-16(4)21(24)23(20)13-17-8-6-5-7-9-17/h5-9,14-16,18-20H,10-13H2,1-4H3/t15-,16?,18+,19-,20?/m1/s1
InChIKey XVRULJYFWVYJEH-GJLSOYBTSA-N
Literature Reference DOI 10.1002/adsc.200700156
Molecular Weight 357.494 g/mol
SMILES C1(N(C(C1C)=O)Cc1ccccc1)C(=O)O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H]
SPLASH splash10-0006-9000000000-b4eb219b6ae499d09279
Source of Spectrum ASC-349-2177/SM11-2g
Wiley ID 1765397