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Methyl 2-chloroicosanoate
SpectraBase Compound ID 5adjHwt9g6Y
InChI InChI=1S/C21H41ClO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(23)24-2/h20H,3-19H2,1-2H3
InChIKey LDTAZFGNIQWIKG-UHFFFAOYSA-N
Mol Weight 361.0 g/mol
Molecular Formula C21H41ClO2
Exact Mass 360.279508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FPJG3JAFiBj
Name Methyl 2-chloroicosanoate
Alternate Name(s) 2-Chloroarachidic acid methyl ester 2-Chloroeicosanoic acid methyl ester Methyl 2-chloranylicosanoate Methyl 2-chloro-eicosanoate
CAS Registry Number 77878-04-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H41ClO2
InChI InChI=1S/C21H41ClO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(23)24-2/h20H,3-19H2,1-2H3
InChIKey LDTAZFGNIQWIKG-UHFFFAOYSA-N
Molecular Weight 361.010 g/mol
SMILES C(CC(C(=O)OC)Cl)CCCCCCCCCCCCCCCC
SPLASH splash10-0a4l-9410000000-7a2c9c276864bc453f71
Source of Spectrum O-23-732-20
Wiley ID 1348494