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(3R,4S,5S)-5-ethyl-3-phenyl-4-propyl-4,5-dihydro-3H-2-benzazepine

View entire compound with spectra: 1 MS (GC)

(3R,4S,5S)-5-ethyl-3-phenyl-4-propyl-4,5-dihydro-3H-2-benzazepine
SpectraBase Compound ID 4LeUmJdKfop
InChI InChI=1S/C21H25N/c1-3-10-20-18(4-2)19-14-9-8-13-17(19)15-22-21(20)16-11-6-5-7-12-16/h5-9,11-15,18,20-21H,3-4,10H2,1-2H3/t18-,20+,21+/m1/s1
InChIKey QFPLYJCFZXITBA-GIVPXCGWSA-N
Mol Weight 291.44 g/mol
Molecular Formula C21H25N
Exact Mass 291.1987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FCYSJEIJl36
Name (3R,4S,5S)-5-ethyl-3-phenyl-4-propyl-4,5-dihydro-3H-2-benzazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25N
InChI InChI=1S/C21H25N/c1-3-10-20-18(4-2)19-14-9-8-13-17(19)15-22-21(20)16-11-6-5-7-12-16/h5-9,11-15,18,20-21H,3-4,10H2,1-2H3/t18-,20+,21+/m1/s1
InChIKey QFPLYJCFZXITBA-GIVPXCGWSA-N
Molecular Weight 291.438 g/mol
SMILES [C@@]1(N=Cc2c([C@]([C@@]1(CCC)[H])(CC)[H])cccc2)(c1ccccc1)[H]
SPLASH splash10-001l-1960000000-cd5eb9681d1fda790b35
Source of Spectrum K1-2004-3475-6
Wiley ID 1561381