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1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-(3-chloro-1-benzothiophen-2-yl)-

View entire compound with spectra: 1 MS (GC)

1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-(3-chloro-1-benzothiophen-2-yl)-
SpectraBase Compound ID 6xZKkZ7le3i
InChI InChI=1S/C17H9ClN2O3S/c18-14-10-3-1-2-4-13(10)24-15(14)17-19-16(20-23-17)9-5-6-11-12(7-9)22-8-21-11/h1-7H,8H2
InChIKey ODGYXXRFNIVWQR-UHFFFAOYSA-N
Mol Weight 356.78 g/mol
Molecular Formula C17H9ClN2O3S
Exact Mass 356.002241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8a4AARRTsWM
Name 1,2,4-Oxadiazole, 3-(1,3-benzodioxol-5-yl)-5-(3-chloro-1-benzothiophen-2-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H9ClN2O3S
InChI InChI=1S/C17H9ClN2O3S/c18-14-10-3-1-2-4-13(10)24-15(14)17-19-16(20-23-17)9-5-6-11-12(7-9)22-8-21-11/h1-7H,8H2
InChIKey ODGYXXRFNIVWQR-UHFFFAOYSA-N
Molecular Weight 356.783 g/mol
SMILES c1c2c(ccc1-c1noc(n1)-c1c(c3c(s1)cccc3)Cl)OCO2
SPLASH splash10-0002-2900000000-a040cc5d6b1070247a2b
Source of Spectrum IY-2-5166-1
Synonyms 3-(2H-1,3-benzodioxol-5-yl)-5-(3-chloro-1-benzothiophen-2-yl)-1,2,4-oxadiazole 3-(1,3-benzodioxol-5-yl)-5-(3-chloro-1-benzothiophen-2-yl)-1,2,4-oxadiazole 3-(1,3-benzodioxol-5-yl)-5-(3-chloranyl-1-benzothiophen-2-yl)-1,2,4-oxadiazole
Wiley ID 1659644