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Methyl 4-iodobutyrate
SpectraBase Compound ID Bdx7yTU0qPZ
InChI InChI=1S/C5H9IO2/c1-8-5(7)3-2-4-6/h2-4H2,1H3
InChIKey NBCIIVXSBPDKOM-UHFFFAOYSA-N
Mol Weight 228.03 g/mol
Molecular Formula C5H9IO2
Exact Mass 227.964725 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CUV7gAjmglT
Name Butanoic acid, 4-iodo-, methyl ester
CAS Registry Number 14273-85-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H9IO2
InChI InChI=1S/C5H9IO2/c1-8-5(7)3-2-4-6/h2-4H2,1H3
InChIKey NBCIIVXSBPDKOM-UHFFFAOYSA-N
Molecular Weight 228.029 g/mol
SMILES COC(=O)CCCI
SPLASH splash10-052f-9300000000-47242b9af1aae117af21
Source of Spectrum SD-1981-0-0
Synonyms Methyl 4-iodobutanoate 4-iodobutanoic acid methyl ester 4-iodobutyric acid methyl ester Butyric acid, 4-iodo-, methyl ester Methyl 4-iodanylbutanoate Methyl 4-iodobutyrate
Wiley ID 1228966