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(1R,2R,5S,6S,7S)-N-Cyclohexyl-2-methyl-5-(1-methylethyl)bicyclo[4.1.0]heptane-7-carboxamide
SpectraBase Compound ID IZ2muqQ1Amo
InChI InChI=1S/C18H31NO/c1-11(2)14-10-9-12(3)15-16(14)17(15)18(20)19-13-7-5-4-6-8-13/h11-17H,4-10H2,1-3H3,(H,19,20)/t12-,14+,15-,16+,17+/m1/s1
InChIKey FVSWXQKGUHDUEO-SOKJMZBUSA-N
Mol Weight 277.45 g/mol
Molecular Formula C18H31NO
Exact Mass 277.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2N397W2gcb
Name (1S,2S,5R,6R,7S)-2-isopropyl-5-methyl-bicyclo[4.1.0]heptane-7-carboxylic acid cyclohexylamide
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Formula C18H31NO
InChI InChI=1S/C18H31NO/c1-11(2)14-10-9-12(3)15-16(14)17(15)18(20)19-13-7-5-4-6-8-13/h11-17H,4-10H2,1-3H3,(H,19,20)/t12-,14+,15-,16+,17+/m1/s1
InChIKey FVSWXQKGUHDUEO-SOKJMZBUSA-N
Ionization Type EI
Molecular Weight 277.452 g/mol
SMILES N(C1CCCCC1)C(=O)[C@]1([C@@]2([C@@](CC[C@]([C@]12[H])(C(C)C)[H])(C)[H])[H])[H]
SPLASH splash10-001l-9450000000-7b637eef7556c2392b68
Sample Comments Major diastereomer
Source of Spectrum US20100189863A1
Wiley ID 1842484