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

*Links on SpectraBase are not permalinks.

Hexadecyl chloroacetate

View entire compound with spectra: 1 MS (GC), and 2 Near IR

Hexadecyl chloroacetate
SpectraBase Compound ID FXrgg0rf4V
InChI InChI=1S/C18H35ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-18(20)17-19/h2-17H2,1H3
InChIKey XQHTWCIWGQDGOI-UHFFFAOYSA-N
Mol Weight 318.9 g/mol
Molecular Formula C18H35ClO2
Exact Mass 318.232558 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 818EbG7qkGW
Name Hexadecyl chloroacetate
Alternate Name(s) 2-Chloroacetic acid cetyl ester 2-Chloroacetic acid hexadecyl ester Acetic acid, chloro-, hexadecyl ester Chloroacetic acid, hexadecyl ester Hexadecyl 2-chloranylethanoate Hexadecyl 2-chloroacetate EINECS 257-683-5
CAS Registry Number 52132-58-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H35ClO2
InChI InChI=1S/C18H35ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-18(20)17-19/h2-17H2,1H3
InChIKey XQHTWCIWGQDGOI-UHFFFAOYSA-N
Molecular Weight 318.929 g/mol
SMILES C(CCCCCCCCCCCC)CCCOC(CCl)=O
SPLASH splash10-0a4l-9100000000-234ec9a57cdead542ba3
Wiley ID 1458579