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5-Iodovanillin
SpectraBase Compound ID AnVKNvurHbV
InChI InChI=1S/C8H7IO3/c1-12-7-3-5(4-10)2-6(9)8(7)11/h2-4,11H,1H3
InChIKey FBBCSYADXYILEH-UHFFFAOYSA-N
Mol Weight 278.05 g/mol
Molecular Formula C8H7IO3
Exact Mass 277.943989 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ihmkyr1ZzFW
Name Benzaldehyde, 4-hydroxy-3-iodo-5-methoxy-
CAS Registry Number 5438-36-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7IO3
InChI InChI=1S/C8H7IO3/c1-12-7-3-5(4-10)2-6(9)8(7)11/h2-4,11H,1H3
InChIKey FBBCSYADXYILEH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200303229
Molecular Weight 278.045 g/mol
SMILES Oc1c(cc(C=O)cc1I)OC
SPLASH splash10-00kg-9340000000-770aa75543200cb936a3
Source of Spectrum ASC-346-80-3e'
Synonyms 4-Hydroxy-3-iodo-5-methoxybenzaldehyde 5-Iodovaniline 3-Iodanyl-5-methoxy-4-oxidanyl-benzaldehyde 5-Iodovanillin EINECS 226-617-7 NSC 16678
Wiley ID 1767450