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1-butyl-4-(4-chlorophenyl)triazole

View entire compound with spectra: 1 MS (GC)

1-butyl-4-(4-chlorophenyl)triazole
SpectraBase Compound ID G5S4b1Ocrmn
InChI InChI=1S/C12H14ClN3/c1-2-3-8-16-9-12(14-15-16)10-4-6-11(13)7-5-10/h4-7,9H,2-3,8H2,1H3
InChIKey OQRIPRFDAGDSRX-UHFFFAOYSA-N
Mol Weight 235.72 g/mol
Molecular Formula C12H14ClN3
Exact Mass 235.087625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17PjMmDSTzx
Name 1-butyl-4-(4-chlorophenyl)triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14ClN3
InChI InChI=1S/C12H14ClN3/c1-2-3-8-16-9-12(14-15-16)10-4-6-11(13)7-5-10/h4-7,9H,2-3,8H2,1H3
InChIKey OQRIPRFDAGDSRX-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 235.718 g/mol
Reported Formula C12H14ClN3
SMILES c1(nn[n](c1)CCCC)-c1ccc(cc1)Cl
SPLASH splash10-0f79-0930000000-e74098911834a5872865
Source of Spectrum CN104098518A
Wiley ID 1849798