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3,7-Dimethyl-1-[4-(2H-tetrazol-5-yl)benzyl]xanthine
SpectraBase Compound ID G1Eg7hDTteG
InChI InChI=1S/C15H14N8O2/c1-21-8-16-13-11(21)14(24)23(15(25)22(13)2)7-9-3-5-10(6-4-9)12-17-19-20-18-12/h3-6,8H,7H2,1-2H3,(H,17,18,19,20)
InChIKey VVNKVDUSFKDESW-UHFFFAOYSA-N
Mol Weight 338.33 g/mol
Molecular Formula C15H14N8O2
Exact Mass 338.123972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AJ7J39P08r
Name 3,7-Dimethyl-1-[4-(2H-tetrazol-5-yl)benzyl]xanthine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14N8O2
InChI InChI=1S/C15H14N8O2/c1-21-8-16-13-11(21)14(24)23(15(25)22(13)2)7-9-3-5-10(6-4-9)12-17-19-20-18-12/h3-6,8H,7H2,1-2H3,(H,17,18,19,20)
InChIKey VVNKVDUSFKDESW-UHFFFAOYSA-N
Molecular Weight 338.331 g/mol
SMILES [nH]1c(nnn1)-c1ccc(CN2C(=O)N(C)c3c(C2=O)[n](C)cn3)cc1
SPLASH splash10-053r-8900000000-8469836a65c9096b5436
Synonyms 3,7-Dimethyl-1-[[4-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]purine-2,6-dione 3,7-Dimethyl-1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]purine-2,6-dione Purine-2,6-dione, 3,7-dimethyl-1-[4-(1H-tetrazol-5-yl)benzyl]-3,7-dihydro-
Wiley ID 1438293