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Pyrano[2,3-c]pyrazol-4(1H)-one, 1-(4-chlorophenyl)-3,6-dimethyl-
SpectraBase Compound ID 1txx2gkHjDF
InChI InChI=1S/C14H11ClN2O2/c1-8-7-12(18)13-9(2)16-17(14(13)19-8)11-5-3-10(15)4-6-11/h3-7H,1-2H3
InChIKey AJQOTWXFDWQBQU-UHFFFAOYSA-N
Mol Weight 274.71 g/mol
Molecular Formula C14H11ClN2O2
Exact Mass 274.050905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LczyPdnq6N
Name Pyrano[2,3-c]pyrazol-4(1H)-one, 1-(4-chlorophenyl)-3,6-dimethyl-
CAS Registry Number 114658-01-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11ClN2O2
InChI InChI=1S/C14H11ClN2O2/c1-8-7-12(18)13-9(2)16-17(14(13)19-8)11-5-3-10(15)4-6-11/h3-7H,1-2H3
InChIKey AJQOTWXFDWQBQU-UHFFFAOYSA-N
Molecular Weight 274.707 g/mol
SMILES c12c(c(C)n[n]2-c2ccc(cc2)Cl)C(=O)C=C(O1)C
SPLASH splash10-05i3-2090000000-d920f5cdf0993437caa4
Source of Spectrum AJ-60-4430-5
Synonyms 1-(4-Chlorophenyl)-3,6-dimethylpyrano[2,3-c]pyrazol-4(1H)-one 1-(4-Chlorophenyl)-3,6-dimethylpyrano[4,3-c]pyranol-4-(1H)-one
Wiley ID 1277912