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4-Benzyl-3,6,6'-trimethyl-2,3,4,6,7,8,9,9a-octahydro-7,9a-methano-1H-benzo[d]azepine
SpectraBase Compound ID E5D72H10A3Y
InChI InChI=1S/C21H29N/c1-20(2)17-9-10-21(15-17)11-12-22(3)18(14-19(20)21)13-16-7-5-4-6-8-16/h4-8,14,17-18H,9-13,15H2,1-3H3
InChIKey AYQFWGWFESXDHP-UHFFFAOYSA-N
Mol Weight 295.47 g/mol
Molecular Formula C21H29N
Exact Mass 295.23 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LobGBxygkxM
Name 4-Benzyl-3,6,6'-trimethyl-2,3,4,6,7,8,9,9a-octahydro-7,9a-methano-1H-benzo[d]azepine
Alternate Name(s) (S)-5-Benzyl-4,8,8-trimethyl-4-aza-tricyclo[5.4.0.1*1,9*]dodecane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29N
InChI InChI=1S/C21H29N/c1-20(2)17-9-10-21(15-17)11-12-22(3)18(14-19(20)21)13-16-7-5-4-6-8-16/h4-8,14,17-18H,9-13,15H2,1-3H3
InChIKey AYQFWGWFESXDHP-UHFFFAOYSA-N
Molecular Weight 295.470 g/mol
SMILES C=12C3(CC(C2(C)C)CC3)CCN(C(C1)Cc1ccccc1)C
SPLASH splash10-0udi-1190000000-469a8faedaf9ae681f75
Source of Spectrum U1-1999-521-9
Wiley ID 752443