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Neopentyl chloroacetate
SpectraBase Compound ID 2cE6D14n3O5
InChI InChI=1S/C7H13ClO2/c1-7(2,3)5-10-6(9)4-8/h4-5H2,1-3H3
InChIKey JRPYLONXEYCUNV-UHFFFAOYSA-N
Mol Weight 164.63 g/mol
Molecular Formula C7H13ClO2
Exact Mass 164.060407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1U3oGsRL4bj
Name Neopentyl chloroacetate
CAS Registry Number 126176-76-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13ClO2
InChI InChI=1S/C7H13ClO2/c1-7(2,3)5-10-6(9)4-8/h4-5H2,1-3H3
InChIKey JRPYLONXEYCUNV-UHFFFAOYSA-N
Molecular Weight 164.632 g/mol
SMILES CC(C)(C)COC(=O)CCl
SPLASH splash10-0a4i-9000000000-1c2c3f334162d0c122b7
Source of Spectrum NP-17-4016-0
Synonyms Chloroacetic acid, 2,2-dimethylpropyl ester 2-Chloroacetic acid 2,2-dimethylpropyl ester 2,2-Dimethylpropyl 2-chloroacetate 2,2-Dimethylpropyl 2-chloranylethanoate
Wiley ID 1100382