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2,3-Dihydro-3-(2',2'-dimethylpropyl)-2-[N-(methylsulfonyl)imino]-5-phenyl-1H-benz[b]azepine
SpectraBase Compound ID 73vi0KGIc24
InChI InChI=1S/C22H26N2O2S/c1-22(2,3)15-17-14-19(16-10-6-5-7-11-16)18-12-8-9-13-20(18)23-21(17)24-27(4,25)26/h5-14,17H,15H2,1-4H3,(H,23,24)
InChIKey WPXNMEOOOUJERE-UHFFFAOYSA-N
Mol Weight 382.52 g/mol
Molecular Formula C22H26N2O2S
Exact Mass 382.171499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ei20WkUeiz
Name 2,3-Dihydro-3-(2',2'-dimethylpropyl)-2-[N-(methylsulfonyl)imino]-5-phenyl-1H-benz[b]azepine
Alternate Name(s) N-[(2Z)-3-neopentyl-5-phenyl-1,3-dihydro-2H-1-benzazepin-2-ylidene]methanesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O2S
InChI InChI=1S/C22H26N2O2S/c1-22(2,3)15-17-14-19(16-10-6-5-7-11-16)18-12-8-9-13-20(18)23-21(17)24-27(4,25)26/h5-14,17H,15H2,1-4H3,(H,23,24)
InChIKey WPXNMEOOOUJERE-UHFFFAOYSA-N
Molecular Weight 382.522 g/mol
SMILES N1c2c(C(=CC(\C1=N/S(=O)(=O)C)CC(C)(C)C)c1ccccc1)cccc2
SPLASH splash10-0kft-0091000000-49853ba55520e8c382c2
Source of Spectrum K1-2000-518-21
Wiley ID 749661