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Isoquinolline-7,8-dicarboxylic acid, 1,2,3,4,5,6-hexahydro-2-benzyl-6-phenyl-, dimethyl ester
SpectraBase Compound ID EVy1sRotJKq
InChI InChI=1S/C26H27NO4/c1-30-25(28)23-21(19-11-7-4-8-12-19)15-20-13-14-27(16-18-9-5-3-6-10-18)17-22(20)24(23)26(29)31-2/h3-12,21H,13-17H2,1-2H3
InChIKey RGEJYKCJKNWEEP-UHFFFAOYSA-N
Mol Weight 417.51 g/mol
Molecular Formula C26H27NO4
Exact Mass 417.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LIJr4SDqDnY
Name Isoquinolline-7,8-dicarboxylic acid, 1,2,3,4,5,6-hexahydro-2-benzyl-6-phenyl-, dimethyl ester
Alternate Name(s) 2-Benzyl-6-phenyl-3,4,5,6-tetrahydro-1H-isoquinoline-7,8-dicarboxylic acid dimethyl ester 6-Phenyl-2-(phenylmethyl)-3,4,5,6-tetrahydro-1H-isoquinoline-7,8-dicarboxylic acid dimethyl ester Dimethyl 2-benzyl-6-phenyl-1,2,3,4,5,6-hexahydro-7,8-isoquinolinedicarboxylate Dimethyl 2-benzyl-6-phenyl-3,4,5,6-tetrahydro-1H-isoquinoline-7,8-dicarboxylate Dimethyl 6-phenyl-2-(phenylmethyl)-3,4,5,6-tetrahydro-1H-isoquinoline-7,8-dicarboxylate
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Formula C26H27NO4
InChI InChI=1S/C26H27NO4/c1-30-25(28)23-21(19-11-7-4-8-12-19)15-20-13-14-27(16-18-9-5-3-6-10-18)17-22(20)24(23)26(29)31-2/h3-12,21H,13-17H2,1-2H3
InChIKey RGEJYKCJKNWEEP-UHFFFAOYSA-N
Molecular Weight 417.505 g/mol
SMILES C12=C(C(=C(C(C2)c2ccccc2)C(OC)=O)C(=O)OC)CN(CC1)Cc1ccccc1
SPLASH splash10-0006-9332000000-5c19fb067dcf38b09b5e
Source of Spectrum AD-0-2532-0
Wiley ID 1428682