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(1R*,2R*)-7-chloro-8-methoxy-2-(methoxycarbonyl)-N-methyl-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin
SpectraBase Compound ID 5ybgWybxUch
InChI InChI=1S/C20H22ClNO3/c1-22-10-9-14-11-16(21)17(24-2)12-15(14)18(19(22)20(23)25-3)13-7-5-4-6-8-13/h4-8,11-12,18-19H,9-10H2,1-3H3/t18-,19-/m1/s1
InChIKey UOXMOVPINDCOHV-RTBURBONSA-N
Mol Weight 359.85 g/mol
Molecular Formula C20H22ClNO3
Exact Mass 359.128821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6UnTtcCpFzi
Name (1R*,2R*)-7-chloro-8-methoxy-2-(methoxycarbonyl)-N-methyl-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin
Comments Less than 3 mono-isotopic peaks
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Formula C20H22ClNO3
InChI InChI=1S/C20H22ClNO3/c1-22-10-9-14-11-16(21)17(24-2)12-15(14)18(19(22)20(23)25-3)13-7-5-4-6-8-13/h4-8,11-12,18-19H,9-10H2,1-3H3/t18-,19-/m1/s1
InChIKey UOXMOVPINDCOHV-RTBURBONSA-N
Molecular Weight 359.853 g/mol
SMILES c12[C@]([C@@](N(C)CCc2cc(c(c1)OC)Cl)(C(=O)OC)[H])(c1ccccc1)[H]
SPLASH splash10-0udi-0009000000-7029071f8a6ce5d113b8
Source of Spectrum U1-2010-4400-1l
Synonyms (1R*,2R*)-7-Chloro-8-methoxy-3-methyl-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-2-carboxylic acid methyl ester methyl (4R,5R)-8-chloro-7-methoxy-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-4-carboxylate methyl (4R,5R)-8-chloranyl-7-methoxy-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepine-4-carboxylate
Wiley ID 1664242