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3-[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]-3-hydroxybutan-2-one
SpectraBase Compound ID 8apE1GvTI2T
InChI InChI=1S/C12H11ClN2O3/c1-7(16)12(2,17)11-15-14-10(18-11)8-3-5-9(13)6-4-8/h3-6,17H,1-2H3
InChIKey JHFQRYMVNGZCSK-UHFFFAOYSA-N
Mol Weight 266.68 g/mol
Molecular Formula C12H11ClN2O3
Exact Mass 266.04582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5rOqIp812JF
Name 3-[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]-3-hydroxybutan-2-one
Alternate Name(s) 3-(5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl)-3-hydroxybutan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClN2O3
InChI InChI=1S/C12H11ClN2O3/c1-7(16)12(2,17)11-15-14-10(18-11)8-3-5-9(13)6-4-8/h3-6,17H,1-2H3
InChIKey JHFQRYMVNGZCSK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000219
Molecular Weight 266.684 g/mol
SMILES OC(c1oc(-c2ccc(cc2)Cl)nn1)(C(=O)C)C
SPLASH splash10-00di-0690000000-336e02af314450c15e49
Source of Spectrum H-94-285-4a
Wiley ID 1785930