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2-[(9E)-9-Octadecenyl]succinic acid
SpectraBase Compound ID EQoVMpXqsSI
InChI InChI=1S/C22H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(22(25)26)19-21(23)24/h9-10,20H,2-8,11-19H2,1H3,(H,23,24)(H,25,26)/b10-9+
InChIKey XACKAZKMZQZZDT-MDZDMXLPSA-N
Mol Weight 368.6 g/mol
Molecular Formula C22H40O4
Exact Mass 368.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1A57hxkIPJx
Name 2-[(9E)-9-Octadecenyl]succinic acid
CAS Registry Number 28777-98-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H40O4
InChI InChI=1S/C22H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(22(25)26)19-21(23)24/h9-10,20H,2-8,11-19H2,1H3,(H,23,24)(H,25,26)/b10-9+
InChIKey XACKAZKMZQZZDT-MDZDMXLPSA-N
Molecular Weight 368.558 g/mol
SMILES OC(C(CC(=O)O)CCCCCCCC\C=C\CCCCCCCC)=O
SPLASH splash10-054o-9620000000-b18654ebf5e2cd2e99fa
Source of Spectrum NP-13-4635-0
Synonyms 9-Octadecenylsuccinic acid Octadecenylsuccinic acid 2-[(E)-octadec-9-enyl]butanedioic acid
Wiley ID 1111071