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Propanedioic acid, (4-iodo-2-butenyl)-, diethyl ester, (E)-
SpectraBase Compound ID 3Qkpcudn3is
InChI InChI=1S/C11H17IO4/c1-3-15-10(13)9(7-5-6-8-12)11(14)16-4-2/h5-6,9H,3-4,7-8H2,1-2H3/b6-5+
InChIKey JPIFKXIETACOST-AATRIKPKSA-N
Mol Weight 340.16 g/mol
Molecular Formula C11H17IO4
Exact Mass 340.017154 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BL9bZappfpA
Name Propanedioic acid, (4-iodo-2-butenyl)-, diethyl ester, (E)-
CAS Registry Number 92173-11-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17IO4
InChI InChI=1S/C11H17IO4/c1-3-15-10(13)9(7-5-6-8-12)11(14)16-4-2/h5-6,9H,3-4,7-8H2,1-2H3/b6-5+
InChIKey JPIFKXIETACOST-AATRIKPKSA-N
Molecular Weight 340.157 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)C\C=C\CI
SPLASH splash10-03xs-9640000000-8fa73e55d25c17052e86
Source of Spectrum AJ-57-1125-4
Synonyms Diethyl (4-iodo-2-butenyl)propanedioate Diethyl 2-[(2E)-4-iodo-2-butenyl]malonate
Wiley ID 1334789