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(3S,4R)-1-oxidanylidene-3-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinoline-4-carboxylic acid
SpectraBase Compound ID IsJRmm1zC0G
InChI InChI=1S/C23H19NO3/c25-22-19-14-8-7-13-18(19)20(23(26)27)21(17-11-5-2-6-12-17)24(22)15-16-9-3-1-4-10-16/h1-14,20-21H,15H2,(H,26,27)/t20-,21-/m1/s1
InChIKey FAMMJLSSKHNSJS-NHCUHLMSSA-N
Mol Weight 357.41 g/mol
Molecular Formula C23H19NO3
Exact Mass 357.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAINbf96CJF
Name (3S,4R)-1-oxidanylidene-3-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinoline-4-carboxylic acid
Alternate Name(s) (3S,4R)-1-oxo-3-phenyl-2-(phenylmethyl)-3,4-dihydroisoquinoline-4-carboxylic acid (3S,4R)-2-benzyl-1-keto-3-phenyl-3,4-dihydroisoquinoline-4-carboxylic acid (3S,4R)-2-benzyl-1-oxo-3-phenyl-3,4-dihydroisoquinoline-4-carboxylic acid
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Formula C23H19NO3
InChI InChI=1S/C23H19NO3/c25-22-19-14-8-7-13-18(19)20(23(26)27)21(17-11-5-2-6-12-17)24(22)15-16-9-3-1-4-10-16/h1-14,20-21H,15H2,(H,26,27)/t20-,21-/m1/s1
InChIKey FAMMJLSSKHNSJS-NHCUHLMSSA-N
Molecular Weight 357.409 g/mol
SMILES OC([C@]1([C@](N(C(c2ccccc12)=O)Cc1ccccc1)(c1ccccc1)[H])[H])=O
SPLASH splash10-014l-9722000000-79fa39db8f7c860678c4
Source of Spectrum O1-63-2015-3
Wiley ID 1592805