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chloroacetic acid, heptyl ester
SpectraBase Compound ID Cr3rGqDfN91
InChI InChI=1S/C9H17ClO2/c1-2-3-4-5-6-7-12-9(11)8-10/h2-8H2,1H3
InChIKey JUFPTDUONWPUBM-UHFFFAOYSA-N
Mol Weight 192.69 g/mol
Molecular Formula C9H17ClO2
Exact Mass 192.091707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2of2WxAUbId
Name Heptyl chloroacetate
Alternate Name(s) Chloroacetic acid, heptyl ester Heptyl 2-chloroacetate Heptyl 2-chloranylethanoate
CAS Registry Number 34589-22-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H17ClO2
InChI InChI=1S/C9H17ClO2/c1-2-3-4-5-6-7-12-9(11)8-10/h2-8H2,1H3
InChIKey JUFPTDUONWPUBM-UHFFFAOYSA-N
Molecular Weight 192.686 g/mol
SMILES CCCCCCCOC(=O)CCl
SPLASH splash10-0a4l-9000000000-8d551f6598992266ef23
Source of Spectrum NP-3-6097-0
Wiley ID 1102982