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Benzeneethanamine, .alpha.-(2,3-dimethyl-1,3-butadienyl)-N-(phenylmethyl)-, [S-(E)]-
SpectraBase Compound ID 6OSJJiME3lR
InChI InChI=1S/C21H25N/c1-17(2)18(3)14-21(15-19-10-6-4-7-11-19)22-16-20-12-8-5-9-13-20/h4-14,21-22H,1,15-16H2,2-3H3/b18-14+/t21-/m1/s1
InChIKey BRMSSZQRCDFVNH-IYYMRFBLSA-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 D6hVPjiHE1J
Name Benzeneethanamine, .alpha.-(2,3-dimethyl-1,3-butadienyl)-N-(phenylmethyl)-, [S-(E)]-
CAS Registry Number 74974-78-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25N
InChI InChI=1S/C21H25N/c1-17(2)18(3)14-21(15-19-10-6-4-7-11-19)22-16-20-12-8-5-9-13-20/h4-14,21-22H,1,15-16H2,2-3H3/b18-14+/t21-/m1/s1
InChIKey BRMSSZQRCDFVNH-IYYMRFBLSA-N
Molecular Weight 291.438 g/mol
SMILES N([C@](\C=C\(C(=C)C)C)(Cc1ccccc1)[H])Cc1ccccc1
SPLASH splash10-0udi-0090000000-f20c7a4010fda15c90a6
Source of Spectrum C-104-5725-0
Synonyms (2S)-(E)-N,N-benzyl-2-(4,5-dimethyl-1-phenyl)hexa-3,5-dienylamine (2S,3E)-N-benzyl-4,5-dimethyl-1-phenyl-3,5-hexadien-2-amine N-benzyl-N-[(1S,2E)-1-benzyl-3,4-dimethyl-2,4-pentadienyl]amine
Wiley ID 1294815