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3-benzyl-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
SpectraBase Compound ID 8ffjFtY5yNr
InChI InChI=1S/C11H9N5O/c17-11-9-10(12-7-13-11)16(15-14-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,13,17)
InChIKey GKILZMOZUNSGBZ-UHFFFAOYSA-N
Mol Weight 227.23 g/mol
Molecular Formula C11H9N5O
Exact Mass 227.08071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5oLy2UkUPIO
Name 3-Benzyl-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Alternate Name(s) 7H-1,2,3-Triazolo[4,5-d]pyrimidin-7-one, 3,6-dihydro-3-benzyl-
CAS Registry Number 21324-31-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N5O
InChI InChI=1S/C11H9N5O/c17-11-9-10(12-7-13-11)16(15-14-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,13,17)
InChIKey GKILZMOZUNSGBZ-UHFFFAOYSA-N
Molecular Weight 227.227 g/mol
SMILES N1C(c2c(N=C1)[n](nn2)Cc1ccccc1)=O
SPLASH splash10-00dm-7900000000-a411cd2d11fdced24362
Wiley ID 1456696