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3-Amino-2-benzyl-6-chloro-5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-2-ium Chloride
SpectraBase Compound ID 4dPnXd5r2yf
InChI InChI=1S/C14H14ClN5.ClH/c1-9-12(15)10(2)20-13(16)19(18-14(20)17-9)8-11-6-4-3-5-7-11;/h3-7,16H,8H2,1-2H3;1H
InChIKey BMBAYEGMXJBBGI-UHFFFAOYSA-N
Mol Weight 324.21 g/mol
Molecular Formula C14H15Cl2N5
Exact Mass 323.070451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ff9UQQ1SbZD
Name 3-Amino-2-benzyl-6-chloro-5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-2-ium Chloride
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15Cl2N5
InChI InChI=1S/C14H14ClN5.ClH/c1-9-12(15)10(2)20-13(16)19(18-14(20)17-9)8-11-6-4-3-5-7-11;/h3-7,16H,8H2,1-2H3;1H
InChIKey BMBAYEGMXJBBGI-UHFFFAOYSA-N
Molecular Weight 324.215 g/mol
SMILES [Cl-].Nc1[n+](Cc2ccccc2)nc2[n]1C(=C(C(C)=N2)Cl)C
SPLASH splash10-0006-9210000000-ad5d7d14b1c7dcb0d994
Source of Spectrum HC-48-1418-3b
Synonyms 3-Amino-2-benzyl-6-chloro-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidin-2-ium chloride
Wiley ID 1739143