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2-Propanone, 1-[2-(3-chlorophenyl)-2H-1,2,3-triazol-4-yl]-
SpectraBase Compound ID IxqLAPryyQ
InChI InChI=1S/C11H10ClN3O/c1-8(16)5-10-7-13-15(14-10)11-4-2-3-9(12)6-11/h2-4,6-7H,5H2,1H3
InChIKey CHEWPERSMBVDTP-UHFFFAOYSA-N
Mol Weight 235.67 g/mol
Molecular Formula C11H10ClN3O
Exact Mass 235.05124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77jOzGjvlMI
Name 2-Propanone, 1-[2-(3-chlorophenyl)-2H-1,2,3-triazol-4-yl]-
CAS Registry Number 54833-33-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10ClN3O
InChI InChI=1S/C11H10ClN3O/c1-8(16)5-10-7-13-15(14-10)11-4-2-3-9(12)6-11/h2-4,6-7H,5H2,1H3
InChIKey CHEWPERSMBVDTP-UHFFFAOYSA-N
Molecular Weight 235.674 g/mol
SMILES CC(Cc1cn[n](-c2cccc(c2)Cl)n1)=O
SPLASH splash10-0006-7900000000-93e0010fdaf753e266ff
Source of Spectrum TA-0-1226-0
Synonyms 1-[2-(3-Chlorophenyl)-2H-1,2,3-triazol-4-yl]acetone 1-[2-(3-chlorophenyl)-1,2,3-triazol-4-yl]propan-2-one 1-[2-(3-chlorophenyl)-4-triazolyl]-2-propanone 1-[2-(3-chlorophenyl)triazol-4-yl]acetone 1-[2-(3-chlorophenyl)triazol-4-yl]propan-2-one
Wiley ID 31885