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7-Amino-3-(2-ethenyl)-3H-1,2,3-triazolo[4,5-d]pyrimidine
SpectraBase Compound ID JjCIFYz9CSh
InChI InChI=1S/C7H8N6/c1-2-3-13-7-5(11-12-13)6(8)9-4-10-7/h2,4H,1,3H2,(H2,8,9,10)
InChIKey CLOOJJIVLZIHBC-UHFFFAOYSA-N
Mol Weight 176.18 g/mol
Molecular Formula C7H8N6
Exact Mass 176.081044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1oRY9h1Rez
Name 7-Amino-3-(2-ethenyl)-3H-1,2,3-triazolo[4,5-d]pyrimidine
Comments Less than 3 mono-isotopic peaks
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Formula C7H8N6
InChI InChI=1S/C7H8N6/c1-2-3-13-7-5(11-12-13)6(8)9-4-10-7/h2,4H,1,3H2,(H2,8,9,10)
InChIKey CLOOJJIVLZIHBC-UHFFFAOYSA-N
Molecular Weight 176.183 g/mol
SMILES Nc1c2nn[n](c2ncn1)CC=C
SPLASH splash10-0002-0900000000-37a5c35b0f1c59908e18
Source of Spectrum J-61-6202-4
Synonyms 7-Amino-3-(propenyl)-3H-1,2,3-triazolo[4,5-d]pyrimidine 3-prop-2-enyl-7-triazolo[4,5-d]pyrimidinamine 3-prop-2-enyltriazolo[4,5-d]pyrimidin-7-amine 3-allyltriazolo[4,5-d]pyrimidin-7-amine 3-prop-2-enyl-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine
Wiley ID 1171906