For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Acetic acid, chloro-, 1-methylheptyl ester
SpectraBase Compound ID 3DcBZvDv33K
InChI InChI=1S/C10H19ClO2/c1-3-4-5-6-7-9(2)13-10(12)8-11/h9H,3-8H2,1-2H3
InChIKey IJDHTIMWHATBKH-UHFFFAOYSA-N
Mol Weight 206.71 g/mol
Molecular Formula C10H19ClO2
Exact Mass 206.107358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3selJrVawpB
Name Acetic acid, chloro-, 1-methylheptyl ester
Alternate Name(s) 1-Methylheptyl chloroacetate Chloroacetic acid, 2-octyl ester 2-Chloroacetic acid octan-2-yl ester Octan-2-yl 2-chloroacetate 1-Methylheptyl 2-chloroacetate Octan-2-yl 2-chloranylethanoate
CAS Registry Number 20411-47-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H19ClO2
InChI InChI=1S/C10H19ClO2/c1-3-4-5-6-7-9(2)13-10(12)8-11/h9H,3-8H2,1-2H3
InChIKey IJDHTIMWHATBKH-UHFFFAOYSA-N
Molecular Weight 206.713 g/mol
SMILES C(Cl)C(=O)OC(CCCCCC)C
SPLASH splash10-05fr-9200000000-9f0c25a44f64a7ce885b
Source of Spectrum NP-4-4284-0
Wiley ID 1103931