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(1S,2R,.alpha.R)-2-[N-(.alpha.-Methylbenzyl)amino]-1-carbethoxycyclohexane
SpectraBase Compound ID FMIpq9kK6bG
InChI InChI=1S/C17H25NO2/c1-3-20-17(19)15-11-7-8-12-16(15)18-13(2)14-9-5-4-6-10-14/h4-6,9-10,13,15-16,18H,3,7-8,11-12H2,1-2H3/t13-,15+,16-/m1/s1
InChIKey LMASLKDDKPUJIF-VNQPRFMTSA-N
Mol Weight 275.39 g/mol
Molecular Formula C17H25NO2
Exact Mass 275.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14Ii53cpN83
Name (1S,2R,.alpha.R)-2-[N-(.alpha.-Methylbenzyl)amino]-1-carbethoxycyclohexane
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Formula C17H25NO2
InChI InChI=1S/C17H25NO2/c1-3-20-17(19)15-11-7-8-12-16(15)18-13(2)14-9-5-4-6-10-14/h4-6,9-10,13,15-16,18H,3,7-8,11-12H2,1-2H3/t13-,15+,16-/m1/s1
InChIKey LMASLKDDKPUJIF-VNQPRFMTSA-N
Molecular Weight 275.392 g/mol
SMILES N([C@]1([C@@](C(=O)OCC)(CCCC1)[H])[H])[C@@](c1ccccc1)(C)[H]
SPLASH splash10-0c00-0940000000-c3843591296c5dc553f6
Source of Spectrum J-61-5562-2
Synonyms Ethyl (1S,2R)-2-{[(1R)-1-phenylethyl]amino}cyclohexanecarboxylate (1S,2R)-2-[[(1R)-1-phenylethyl]amino]-1-cyclohexanecarboxylic acid ethyl ester Ethyl (1S,2R)-2-[[(1R)-1-phenylethyl]amino]cyclohexanecarboxylate Ethyl (1S,2R)-2-[[(1R)-1-phenylethyl]amino]cyclohexane-1-carboxylate
Wiley ID 1279284