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(S)-2-Allyl-2,3,4,5-tetrahydro-1H-benzo[b]azepine
SpectraBase Compound ID HxZSOxYqVvX
InChI InChI=1S/C13H17N/c1-2-6-12-9-5-8-11-7-3-4-10-13(11)14-12/h2-4,7,10,12,14H,1,5-6,8-9H2/t12-/m1/s1
InChIKey QXUHEONUGVCRLL-GFCCVEGCSA-N
Mol Weight 187.29 g/mol
Molecular Formula C13H17N
Exact Mass 187.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GhjkfWgdxx
Name (S)-2-Allyl-2,3,4,5-tetrahydro-1H-benzo[b]azepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N
InChI InChI=1S/C13H17N/c1-2-6-12-9-5-8-11-7-3-4-10-13(11)14-12/h2-4,7,10,12,14H,1,5-6,8-9H2/t12-/m1/s1
InChIKey QXUHEONUGVCRLL-GFCCVEGCSA-N
Literature Reference DOI 10.1021/jo402759v
Molecular Weight 187.286 g/mol
SMILES N1[C@@](CCCc2c1cccc2)(CC=C)[H]
SPLASH splash10-0002-0900000000-2c8c51a07dbb09bc9661
Source of Spectrum J-79-1365-14c
Wiley ID 1746078