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Elaidicacid-iso-propyl ester
SpectraBase Compound ID AUtlhZsIewY
InChI InChI=1S/C21H40O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22)23-20(2)3/h11-12,20H,4-10,13-19H2,1-3H3/b12-11+
InChIKey PZQSQRCNMZGWFT-VAWYXSNFSA-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 1qvHXRveim
Name Isopropyl (9E)-9-octadecenoate
CAS Registry Number 22147-34-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40O2
InChI InChI=1S/C21H40O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22)23-20(2)3/h11-12,20H,4-10,13-19H2,1-3H3/b12-11+
InChIKey PZQSQRCNMZGWFT-VAWYXSNFSA-N
Molecular Weight 324.549 g/mol
SMILES CCCCCCCC\C=C\CCCCCCCC(OC(C)C)=O
SPLASH splash10-07bf-9420000000-f20cea47c1c9a7375bce
Source of Spectrum HE-1982-0-0
Synonyms (E)-9-octadecenoic acid propan-2-yl ester (E)-octadec-9-enoic acid isopropyl ester Elaidic acid, isopropyl ester isopropyl (E)-octadec-9-enoate Propan-2-yl (E)-octadec-9-enoate
Wiley ID 1323649