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(+)-1R,11R or 1R,11S-3-[(Beta-Hydroxy)-(4-bromophenyl)ethyl]-7,8-dimethoxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine
SpectraBase Compound ID FqfxQGASzjA
InChI InChI=1S/C26H28BrNO3/c1-30-25-14-20-12-13-28(17-24(29)19-8-10-21(27)11-9-19)16-23(18-6-4-3-5-7-18)22(20)15-26(25)31-2/h3-11,14-15,23-24,29H,12-13,16-17H2,1-2H3/t23-,24?/m1/s1
InChIKey CWARICIHCYWEFE-MIHMCVIASA-N
Mol Weight 482.42 g/mol
Molecular Formula C26H28BrNO3
Exact Mass 481.125257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C5jid6mYQDX
Name (+)-1R,11R or 1R,11S-3-[(Beta-Hydroxy)-(4-bromophenyl)ethyl]-7,8-dimethoxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine
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Formula C26H28BrNO3
InChI InChI=1S/C26H28BrNO3/c1-30-25-14-20-12-13-28(17-24(29)19-8-10-21(27)11-9-19)16-23(18-6-4-3-5-7-18)22(20)15-26(25)31-2/h3-11,14-15,23-24,29H,12-13,16-17H2,1-2H3/t23-,24?/m1/s1
InChIKey CWARICIHCYWEFE-MIHMCVIASA-N
Literature Reference DOI 10.1002/prac.19913330616
Molecular Weight 482.418 g/mol
SMILES OC(CN1C[C@](c2ccccc2)(c2cc(c(cc2CC1)OC)OC)[H])c1ccc(cc1)Br
SPLASH splash10-0002-1090400000-4d230167d614b626b3c7
Source of Spectrum JF-333-929-(+)_3b
Synonyms 1-(4-bromophenyl)-2-((R)-7,8-dimethoxy-1-phenyl-1,2,4,5-tetrahydro-3H-benzo[d]azepin-3-yl)ethan-1-ol
Wiley ID 1789726