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(3E)-4-(4-chlorophenyl)-2-(pyridin-4-yl)-1-(1H-1,2,4-triazol-1-yl)but-3-en-2-ol
SpectraBase Compound ID KxSM279RCBS
InChI InChI=1S/C17H15ClN4O/c18-16-3-1-14(2-4-16)5-8-17(23,11-22-13-20-12-21-22)15-6-9-19-10-7-15/h1-10,12-13,23H,11H2/b8-5+
InChIKey LNPLFCFWGQGYTQ-VMPITWQZSA-N
Mol Weight 326.79 g/mol
Molecular Formula C17H15ClN4O
Exact Mass 326.093439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8pnR7dTeZc
Name (3E)-4-(4-chlorophenyl)-2-(pyridin-4-yl)-1-(1H-1,2,4-triazol-1-yl)but-3-en-2-ol
Alternate Name(s) (E)-4-(4-chlorophenyl)-2-pyridin-4-yl-1-(1,2,4-triazol-1-yl)-3-buten-2-ol (E)-4-(4-chlorophenyl)-2-pyridin-4-yl-1-(1,2,4-triazol-1-yl)but-3-en-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15ClN4O
InChI InChI=1S/C17H15ClN4O/c18-16-3-1-14(2-4-16)5-8-17(23,11-22-13-20-12-21-22)15-6-9-19-10-7-15/h1-10,12-13,23H,11H2/b8-5+
InChIKey LNPLFCFWGQGYTQ-VMPITWQZSA-N
Molecular Weight 326.787 g/mol
SMILES OC(c1ccncc1)(C[n]1cncn1)\C=C\c1ccc(cc1)Cl
SPLASH splash10-0a4i-9880000000-b09a4df046eab4e49105
Source of Spectrum IY-2-4952-7
Wiley ID 1657510