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Heptadecanoic acid, 7-iodo-, methyl ester
SpectraBase Compound ID 9mc5gtFXn0v
InChI InChI=1S/C18H35IO2/c1-3-4-5-6-7-8-9-11-14-17(19)15-12-10-13-16-18(20)21-2/h17H,3-16H2,1-2H3
InChIKey HOJAGRHJDLXDOB-UHFFFAOYSA-N
Mol Weight 410.4 g/mol
Molecular Formula C18H35IO2
Exact Mass 410.168175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7DEI9RwMqM8
Name Heptadecanoic acid, 7-iodo-, methyl ester
CAS Registry Number 57289-61-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H35IO2
InChI InChI=1S/C18H35IO2/c1-3-4-5-6-7-8-9-11-14-17(19)15-12-10-13-16-18(20)21-2/h17H,3-16H2,1-2H3
InChIKey HOJAGRHJDLXDOB-UHFFFAOYSA-N
Molecular Weight 410.380 g/mol
SMILES C(C(CCCCCCCCCC)I)CCCCC(OC)=O
SPLASH splash10-053u-9220000000-b0edba15418bed931ce8
Source of Spectrum EP-8140-0-0
Synonyms Methyl 7-iodoheptadecanoate 7-iodoheptadecanoic acid methyl ester Methyl 7-iodanylheptadecanoate
Wiley ID 1373516