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Isopropyl 8-(3-octyl-2-oxiranyl)octanoate
SpectraBase Compound ID G8Xxe5RHoWU
InChI InChI=1S/C21H40O3/c1-4-5-6-7-9-12-15-19-20(24-19)16-13-10-8-11-14-17-21(22)23-18(2)3/h18-20H,4-17H2,1-3H3
InChIKey KTOXFGSORDAWNM-UHFFFAOYSA-N
Mol Weight 340.5 g/mol
Molecular Formula C21H40O3
Exact Mass 340.297745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9Mb0Kn8J7D
Name Isopropyl 8-(3-octyl-2-oxiranyl)octanoate
Alternate Name(s) 8-(3-octyl-2-oxiranyl)octanoic acid propan-2-yl ester 8-(3-octyloxiran-2-yl)caprylic acid isopropyl ester isopropyl 8-(3-octyloxiran-2-yl)octanoate Octadecanoic acid, 9,10-epoxy-, isopropyl ester Propan-2-yl 8-(3-octyloxiran-2-yl)octanoate
CAS Registry Number 95007-80-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40O3
InChI InChI=1S/C21H40O3/c1-4-5-6-7-9-12-15-19-20(24-19)16-13-10-8-11-14-17-21(22)23-18(2)3/h18-20H,4-17H2,1-3H3
InChIKey KTOXFGSORDAWNM-UHFFFAOYSA-N
Molecular Weight 340.548 g/mol
SMILES C1(OC1CCCCCCCC)CCCCCCCC(=O)OC(C)C
SPLASH splash10-0a4l-9400000000-47dddff9e9d87b8c8fb1
Source of Spectrum HE-1982-0-0
Wiley ID 1335498