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1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-
SpectraBase Compound ID 7WvdfsBHTG6
InChI InChI=1S/C19H12ClN3O4/c1-10-16(17(22-26-10)12-4-2-3-5-13(12)20)19-21-18(23-27-19)11-6-7-14-15(8-11)25-9-24-14/h2-8H,9H2,1H3
InChIKey KGIZSRAQRJPZGD-UHFFFAOYSA-N
Mol Weight 381.78 g/mol
Molecular Formula C19H12ClN3O4
Exact Mass 381.051634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HI3KLADn72V
Name 1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12ClN3O4
InChI InChI=1S/C19H12ClN3O4/c1-10-16(17(22-26-10)12-4-2-3-5-13(12)20)19-21-18(23-27-19)11-6-7-14-15(8-11)25-9-24-14/h2-8H,9H2,1H3
InChIKey KGIZSRAQRJPZGD-UHFFFAOYSA-N
Molecular Weight 381.775 g/mol
SMILES c1c2c(ccc1-c1noc(n1)-c1c(onc1-c1ccccc1Cl)C)OCO2
SPLASH splash10-01r6-8902000000-1ac070c0e79f6c4808b6
Source of Spectrum IY-1-4664-0
Synonyms 3-(1,3-benzodioxol-5-yl)-5-[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]-1,2,4-oxadiazole 3-(1,3-benzodioxol-5-yl)-5-[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]-1,2,4-oxadiazole
Wiley ID 1654623