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2-{3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID FKBDt3xn7iF
InChI InChI=1S/C20H18N6/c1-2-6-15(7-3-1)12-26-20-18(23-24-26)19(21-14-22-20)25-11-10-16-8-4-5-9-17(16)13-25/h1-9,14H,10-13H2
InChIKey PVNRGJFVXNPSCS-UHFFFAOYSA-N
Mol Weight 342.41 g/mol
Molecular Formula C20H18N6
Exact Mass 342.159295 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EeHGlMQdejA
Name 2-{3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl}-1,2,3,4-tetrahydroisoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N6
InChI InChI=1S/C20H18N6/c1-2-6-15(7-3-1)12-26-20-18(23-24-26)19(21-14-22-20)25-11-10-16-8-4-5-9-17(16)13-25/h1-9,14H,10-13H2
InChIKey PVNRGJFVXNPSCS-UHFFFAOYSA-N
Molecular Weight 342.406 g/mol
SMILES c1ccc(cc1)C[n]1nnc2c(ncnc12)N1CCc2c(C1)cccc2
SPLASH splash10-0006-4849000000-c2ed26c66922f4d5eb9c
Source of Spectrum IY-2-4953-5
Synonyms Isoquinoline, 1,2,3,4-tetrahydro-2-[3-(phenylmethyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]- 2-[3-(phenylmethyl)-7-triazolo[4,5-d]pyrimidinyl]-3,4-dihydro-1H-isoquinoline 2-[3-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]-3,4-dihydro-1H-isoquinoline
Wiley ID 1657518