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(3R,4R,5R)-4-methyl-3-phenyl-5-prop-2-enyl-4,5-dihydro-3H-2-benzazepine
SpectraBase Compound ID DNVRSJLCLvQ
InChI InChI=1S/C20H21N/c1-3-9-18-15(2)20(16-10-5-4-6-11-16)21-14-17-12-7-8-13-19(17)18/h3-8,10-15,18,20H,1,9H2,2H3/t15-,18-,20-/m1/s1
InChIKey UFQVDHJCBCOEEL-XFQXTVEOSA-N
Mol Weight 275.39 g/mol
Molecular Formula C20H21N
Exact Mass 275.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBNselRnnc5
Name (3R,4R,5R)-4-methyl-3-phenyl-5-prop-2-enyl-4,5-dihydro-3H-2-benzazepine
Alternate Name(s) (3R,4R,5R)-5-allyl-4-methyl-3-phenyl-4,5-dihydro-3H-2-benzazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N
InChI InChI=1S/C20H21N/c1-3-9-18-15(2)20(16-10-5-4-6-11-16)21-14-17-12-7-8-13-19(17)18/h3-8,10-15,18,20H,1,9H2,2H3/t15-,18-,20-/m1/s1
InChIKey UFQVDHJCBCOEEL-XFQXTVEOSA-N
Molecular Weight 275.395 g/mol
SMILES [C@@]1(N=Cc2c([C@@]([C@]1(C)[H])(CC=C)[H])cccc2)(c1ccccc1)[H]
SPLASH splash10-004i-4960000000-d30093fa89320cb90a3c
Source of Spectrum K1-2004-3474-6
Wiley ID 1561385