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Propanoic acid, 2-methyl-, 2-(chloromethyl)-2-propenyl ester
SpectraBase Compound ID 1jsCLnjm1Su
InChI InChI=1S/C8H13ClO2/c1-6(2)8(10)11-5-7(3)4-9/h6H,3-5H2,1-2H3
InChIKey RDGBJWCBNWKBLC-UHFFFAOYSA-N
Mol Weight 176.64 g/mol
Molecular Formula C8H13ClO2
Exact Mass 176.060407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbL91CvO5wr
Name Propanoic acid, 2-methyl-, 2-(chloromethyl)-2-propenyl ester
Alternate Name(s) 2-(chloromethyl)-2-propenyl 2-methylpropanoate 3-Chloro-2-methylidenepropyl isobutyrate
CAS Registry Number 80500-79-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13ClO2
InChI InChI=1S/C8H13ClO2/c1-6(2)8(10)11-5-7(3)4-9/h6H,3-5H2,1-2H3
InChIKey RDGBJWCBNWKBLC-UHFFFAOYSA-N
Molecular Weight 176.643 g/mol
SMILES C(OCC(=C)CCl)(=O)C(C)C
SPLASH splash10-0006-9100000000-e3c8444b6cf202b83bf6
Source of Spectrum H-64-2399-0
Wiley ID 1172018