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ALLYL STEARATE, TECHNICAL
SpectraBase Compound ID 14rRZkpN6Iz
InChI InChI=1S/C21H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22)23-20-4-2/h4H,2-3,5-20H2,1H3
InChIKey HPCIWDZYMSZAEZ-UHFFFAOYSA-N
Mol Weight 324.5 g/mol
Molecular Formula C21H40O2
Exact Mass 324.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1tBov038F8
Name Octadecanoic acid, 2-propenyl ester
Alternate Name(s) Allyl octadecanoate Allyl stearate Octadecanoic acid prop-2-enyl ester Prop-2-enyl octadecanoate stearic acid allyl ester AI3-23189 EINECS 228-527-3
CAS Registry Number 6289-31-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40O2
InChI InChI=1S/C21H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22)23-20-4-2/h4H,2-3,5-20H2,1H3
InChIKey HPCIWDZYMSZAEZ-UHFFFAOYSA-N
Molecular Weight 324.549 g/mol
SMILES C(CCCCCCCCCCC(=O)OCC=C)CCCCCC
SPLASH splash10-052f-9300000000-cf8be75d8f6dd0ca3f04
Source of Spectrum EP-5367-0-0
Wiley ID 1323647