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(2E,4E,12E)-11-hydroxy-13-iodo-3,7,11-trimethyl-trideca-2,4,12-trienoic acid isopropyl ester
SpectraBase Compound ID 9XGSNOgpKFN
InChI InChI=1S/C19H31IO3/c1-15(2)23-18(21)14-17(4)9-6-8-16(3)10-7-11-19(5,22)12-13-20/h6,9,12-16,22H,7-8,10-11H2,1-5H3/b9-6+,13-12+,17-14+
InChIKey CNKBIWLVNGWUAE-JQMRZUIASA-N
Mol Weight 434.36 g/mol
Molecular Formula C19H31IO3
Exact Mass 434.13179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 50VTWyuso4e
Name (2E,4E,12E)-11-hydroxy-13-iodo-3,7,11-trimethyl-trideca-2,4,12-trienoic acid isopropyl ester
Alternate Name(s) (2E,4E,12E)-11-hydroxy-13-iodo-3,7,11-trimethyltrideca-2,4,12-trienoic acid propan-2-yl ester Iodovinylmethoprenol isopropyl (2E,4E,12E)-11-hydroxy-13-iodo-3,7,11-trimethyl-trideca-2,4,12-trienoate Isopropyl 13-iodo-11-hydroxy-3,7,11-trimethyl-2,4-12-tridecatrienoate IVMA Propan-2-yl (2E,4E,12E)-11-hydroxy-13-iodo-3,7,11-trimethyltrideca-2,4,12-trienoate Propan-2-yl (2E,4E,12E)-13-iodanyl-3,7,11-trimethyl-11-oxidanyl-trideca-2,4,12-trienoate
CAS Registry Number 105373-49-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H31IO3
InChI InChI=1S/C19H31IO3/c1-15(2)23-18(21)14-17(4)9-6-8-16(3)10-7-11-19(5,22)12-13-20/h6,9,12-16,22H,7-8,10-11H2,1-5H3/b9-6+,13-12+,17-14+
InChIKey CNKBIWLVNGWUAE-JQMRZUIASA-N
Molecular Weight 434.358 g/mol
SMILES OC(\C=C\I)(CCCC(C\C=C\C(=C\C(=O)OC(C)C)C)C)C
SPLASH splash10-06u5-8910000000-bb83c983c322fc81118b
Source of Spectrum J-51-5449-10
Wiley ID 1382845