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(2E,4E,6E,9S,10E)-9-hydroxy-11-iodoundeca-2,4,6,10-tetraenoic acid methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(2E,4E,6E,9S,10E)-9-hydroxy-11-iodoundeca-2,4,6,10-tetraenoic acid methyl ester
SpectraBase Compound ID B6urMKHJUme
InChI InChI=1S/C12H15IO3/c1-16-12(15)8-6-4-2-3-5-7-11(14)9-10-13/h2-6,8-11,14H,7H2,1H3/b4-2+,5-3+,8-6+,10-9+/t11-/m0/s1
InChIKey CTSMOLJMIJUECM-WRFMFURKSA-N
Mol Weight 334.15 g/mol
Molecular Formula C12H15IO3
Exact Mass 334.006589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWAxyAKFAFr
Name (2E,4E,6E,9S,10E)-9-hydroxy-11-iodo-undeca-2,4,6,10-tetraenoic acid methyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15IO3
InChI InChI=1S/C12H15IO3/c1-16-12(15)8-6-4-2-3-5-7-11(14)9-10-13/h2-6,8-11,14H,7H2,1H3/b4-2+,5-3+,8-6+,10-9+/t11-/m0/s1
InChIKey CTSMOLJMIJUECM-WRFMFURKSA-N
Molecular Weight 334.153 g/mol
SMILES O[C@](\C=C\I)(C\C=C\C=C\C=C\C(=O)OC)[H]
SPLASH splash10-0udi-2900000000-381310a76d56525864be
Source of Spectrum QE-7-3371-21
Synonyms Methyl (2E,4E,6E,9S,10E)-11-iodanyl-9-oxidanyl-undeca-2,4,6,10-tetraenoate Methyl (2E,4E,6E,9S,10E)-9-hydroxy-11-iodo-undeca-2,4,6,10-tetraenoate (2E,4E,6E,9S,10E)-9-hydroxy-11-iodoundeca-2,4,6,10-tetraenoic acid methyl ester
Wiley ID 845730