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1-(2,4-Dichlorophenyl)-2-(1H-pyrazol-1-yl)allyl acetate
SpectraBase Compound ID 5lFHNeHlbpW
InChI InChI=1S/C14H12Cl2N2O2/c1-9(18-7-3-6-17-18)14(20-10(2)19)12-5-4-11(15)8-13(12)16/h3-8,14H,1H2,2H3
InChIKey AVEZBWQHQPQUKN-UHFFFAOYSA-N
Mol Weight 311.17 g/mol
Molecular Formula C14H12Cl2N2O2
Exact Mass 310.027583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5gTGfdeqxGv
Name 1-(2,4-Dichlorophenyl)-2-(1H-pyrazol-1-yl)allyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12Cl2N2O2
InChI InChI=1S/C14H12Cl2N2O2/c1-9(18-7-3-6-17-18)14(20-10(2)19)12-5-4-11(15)8-13(12)16/h3-8,14H,1H2,2H3
InChIKey AVEZBWQHQPQUKN-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo401867e
Molecular Weight 311.168 g/mol
SMILES c1c(c(C(OC(=O)C)C(=C)[n]2nccc2)ccc1Cl)Cl
SPLASH splash10-0ik9-0097000000-613609191f6ae7a0d354
Source of Spectrum J-78-11832-3m
Synonyms Acetic acid [1-(2,4-dichlorophenyl)-2-(1-pyrazolyl)prop-2-enyl] ester [1-(2,4-dichlorophenyl)-2-pyrazol-1-ylprop-2-enyl] acetate [1-(2,4-dichlorophenyl)-2-pyrazol-1-yl-allyl] acetate [1-(2,4-dichlorophenyl)-2-pyrazol-1-yl-prop-2-enyl] ethanoate
Wiley ID 1747294