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2-(5-Iodopentyl)-malonic acid, diethyl ester

View entire compound with spectra: 2 MS (GC)

2-(5-Iodopentyl)-malonic acid, diethyl ester
SpectraBase Compound ID LopMeguC8oB
InChI InChI=1S/C12H21IO4/c1-3-16-11(14)10(12(15)17-4-2)8-6-5-7-9-13/h10H,3-9H2,1-2H3
InChIKey JDFNXEGAJUTEIB-UHFFFAOYSA-N
Mol Weight 356.2 g/mol
Molecular Formula C12H21IO4
Exact Mass 356.048454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AYVKCagIKvd
Name 2-(5-Iodopentyl)-malonic acid, diethyl ester
CAS Registry Number 54696-24-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21IO4
InChI InChI=1S/C12H21IO4/c1-3-16-11(14)10(12(15)17-4-2)8-6-5-7-9-13/h10H,3-9H2,1-2H3
InChIKey JDFNXEGAJUTEIB-UHFFFAOYSA-N
Molecular Weight 356.200 g/mol
SMILES C(CC(C(OCC)=O)C(=O)OCC)CCCI
SPLASH splash10-004i-9200000000-25200167c847da1961d5
Synonyms 2-(5-iodopentyl)propanedioic acid diethyl ester Diethyl 2-(5-iodanylpentyl)propanedioate Diethyl 2-(5-iodopentyl)malonate Diethyl 2-(5-iodopentyl)propanedioate
Wiley ID 1482822