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Dichloroacetic acid, 2-methyloct-5-yn-4-yl ester
SpectraBase Compound ID EDq5cWcom3o
InChI InChI=1S/C11H16Cl2O2/c1-4-5-6-9(7-8(2)3)15-11(14)10(12)13/h8-10H,4,7H2,1-3H3
InChIKey AHCSRIQXLAZANZ-UHFFFAOYSA-N
Mol Weight 251.15 g/mol
Molecular Formula C11H16Cl2O2
Exact Mass 250.052735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CUbmSvB26OW
Name Dichloroacetic acid, 2-methyloct-5-yn-4-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16Cl2O2
InChI InChI=1S/C11H16Cl2O2/c1-4-5-6-9(7-8(2)3)15-11(14)10(12)13/h8-10H,4,7H2,1-3H3
InChIKey AHCSRIQXLAZANZ-UHFFFAOYSA-N
Molecular Weight 251.153 g/mol
SMILES C(C(=O)OC(C#CCC)CC(C)C)(Cl)Cl
SPLASH splash10-0a5c-9210000000-811971cb9eb8ae707f80
Source of Spectrum NP-7-802-0
Synonyms 2,2-Dichloroacetic acid 2-methyloct-5-yn-4-yl ester 2-Methyloct-5-yn-4-yl 2,2-dichloroacetate 1-isobutylpent-2-ynyl 2,2-dichloroacetate 2-Methyloct-5-yn-4-yl 2,2-bis(chloranyl)ethanoate
Wiley ID 1106257