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(3R,4S,5S)-3-phenyl-5-prop-2-enyl-4-propyl-4,5-dihydro-3H-2-benzazepine
SpectraBase Compound ID 4ssDdlDvI57
InChI InChI=1S/C22H25N/c1-3-10-20-19-15-9-8-14-18(19)16-23-22(21(20)11-4-2)17-12-6-5-7-13-17/h3,5-9,12-16,20-22H,1,4,10-11H2,2H3/t20-,21+,22+/m1/s1
InChIKey RIXLVORTVNOSDM-FSSWDIPSSA-N
Mol Weight 303.45 g/mol
Molecular Formula C22H25N
Exact Mass 303.1987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPO48t6Krrd
Name (3R,4S,5S)-3-phenyl-5-prop-2-enyl-4-propyl-4,5-dihydro-3H-2-benzazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25N
InChI InChI=1S/C22H25N/c1-3-10-20-19-15-9-8-14-18(19)16-23-22(21(20)11-4-2)17-12-6-5-7-13-17/h3,5-9,12-16,20-22H,1,4,10-11H2,2H3/t20-,21+,22+/m1/s1
InChIKey RIXLVORTVNOSDM-FSSWDIPSSA-N
Molecular Weight 303.449 g/mol
SMILES [C@@]1(N=Cc2c([C@]([C@@]1(CCC)[H])(CC=C)[H])cccc2)(c1ccccc1)[H]
SPLASH splash10-0096-2950000000-9db81dafe2fac6a450b9
Source of Spectrum K1-2004-3475-6
Synonyms (3R,4S,5S)-5-allyl-3-phenyl-4-propyl-4,5-dihydro-3H-2-benzazepine
Wiley ID 1561380