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MCPB-methyl ester
SpectraBase Compound ID 26B5TzX13pv
InChI InChI=1S/C12H15ClO3/c1-9-8-10(13)5-6-11(9)16-7-3-4-12(14)15-2/h5-6,8H,3-4,7H2,1-2H3
InChIKey FWDQLSHRVKQKBS-UHFFFAOYSA-N
Mol Weight 242.7 g/mol
Molecular Formula C12H15ClO3
Exact Mass 242.070972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TLJASyH3DT
Name MCPB-methyl ester
Source of Sample Supelco Cat. #PS1084
CAS Registry Number 57153-18-1
Classification Pesticides: Herbicides
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15ClO3
InChI InChI=1S/C12H15ClO3/c1-9-8-10(13)5-6-11(9)16-7-3-4-12(14)15-2/h5-6,8H,3-4,7H2,1-2H3
InChIKey FWDQLSHRVKQKBS-UHFFFAOYSA-N
Number of Peaks 48
RI1 1785
SMILES c1(C)c(ccc(Cl)c1)OCCCC(=O)OC
SPLASH splash10-14i0-9800000000-36e0bff6226da1a24292
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Butanoic acid, 4-(4-chloro-2-methylphenoxy)-, methyl ester
Wiley ID LM_PEST_661