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3-Cyclohexen-1-amine, N,N-dimethyl-2,5,6-triphenyl-, (1.alpha.,2.alpha.,5.alpha.,6.beta.)-
SpectraBase Compound ID FDYjWeB28fT
InChI InChI=1S/C26H27N/c1-27(2)26-24(21-14-8-4-9-15-21)19-18-23(20-12-6-3-7-13-20)25(26)22-16-10-5-11-17-22/h3-19,23-26H,1-2H3/t23-,24+,25-,26-/m1/s1
InChIKey YCGAXNFHZXSVDI-XDZVQPMWSA-N
Mol Weight 353.51 g/mol
Molecular Formula C26H27N
Exact Mass 353.21435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yIUfmW6PHm
Name 3-Cyclohexen-1-amine, N,N-dimethyl-2,5,6-triphenyl-, (1.alpha.,2.alpha.,5.alpha.,6.beta.)-
Alternate Name(s) (1R,2S,5S,6S)-N,N-dimethyl-2,5,6-triphenyl-3-cyclohexen-1-amine 3,6-Diphenyl-5-trans phenyl-4-cis N-dimethylamino-cyclohexene N,N-dimethyl-N-[(1R,2S,5S,6S)-2,5,6-triphenyl-3-cyclohexen-1-yl]amine
CAS Registry Number 42715-10-6
Comments Less than 3 mono-isotopic peaks
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Formula C26H27N
InChI InChI=1S/C26H27N/c1-27(2)26-24(21-14-8-4-9-15-21)19-18-23(20-12-6-3-7-13-20)25(26)22-16-10-5-11-17-22/h3-19,23-26H,1-2H3/t23-,24+,25-,26-/m1/s1
InChIKey YCGAXNFHZXSVDI-XDZVQPMWSA-N
Molecular Weight 353.509 g/mol
SMILES [C@]1([C@@]([C@@](c2ccccc2)(C=C[C@]1(c1ccccc1)[H])[H])(c1ccccc1)[H])(N(C)C)[H]
SPLASH splash10-0002-0900000000-820d22cc8ddb4afad730
Source of Spectrum O7-0-619-0
Wiley ID 1344151