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(3S,4R)-2-(tert-Butoxycarbonyl)-3-benzyl-4-ethenyl-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID uXdJUGs6Dd
InChI InChI=1S/C23H27NO2/c1-5-19-20-14-10-9-13-18(20)16-24(22(25)26-23(2,3)4)21(19)15-17-11-7-6-8-12-17/h5-14,19,21H,1,15-16H2,2-4H3/t19-,21+/m1/s1
InChIKey IKRMUSABNHKTHK-CTNGQTDRSA-N
Mol Weight 349.47 g/mol
Molecular Formula C23H27NO2
Exact Mass 349.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcI3JkNX6nE
Name (3S,4R)-2-(tert-Butoxycarbonyl)-3-benzyl-4-ethenyl-1,2,3,4-tetrahydroisoquinoline
Alternate Name(s) tert-Butyl (3S,4R)-3-benzyl-4-vinyl-3,4-dihydro-2(1H)-isoquinolinecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27NO2
InChI InChI=1S/C23H27NO2/c1-5-19-20-14-10-9-13-18(20)16-24(22(25)26-23(2,3)4)21(19)15-17-11-7-6-8-12-17/h5-14,19,21H,1,15-16H2,2-4H3/t19-,21+/m1/s1
InChIKey IKRMUSABNHKTHK-CTNGQTDRSA-N
Molecular Weight 349.474 g/mol
SMILES C1N([C@]([C@@](c2ccccc12)(C=C)[H])(Cc1ccccc1)[H])C(=O)OC(C)(C)C
SPLASH splash10-0pb9-4490000000-1d0a322ab0bab6948f25
Source of Spectrum SO-0-1334-10
Wiley ID 1545333