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2-Allyl-3-keto-glutaric acid diethyl ester
SpectraBase Compound ID 8kSpuYwB44T
InChI InChI=1S/C12H18O5/c1-4-7-9(12(15)17-6-3)10(13)8-11(14)16-5-2/h4,9H,1,5-8H2,2-3H3
InChIKey OJTDHRJHKRKDFT-UHFFFAOYSA-N
Mol Weight 242.27 g/mol
Molecular Formula C12H18O5
Exact Mass 242.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TGHxP5LuPq
Name 2-Allyl-3-keto-glutaric acid diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O5
InChI InChI=1S/C12H18O5/c1-4-7-9(12(15)17-6-3)10(13)8-11(14)16-5-2/h4,9H,1,5-8H2,2-3H3
InChIKey OJTDHRJHKRKDFT-UHFFFAOYSA-N
Molecular Weight 242.271 g/mol
SMILES C(C(C(=O)OCC)CC=C)(CC(=O)OCC)=O
SPLASH splash10-0pc0-9500000000-eac0e6ba626f06974d21
Source of Spectrum M-32-150-8
Synonyms 3-Oxo-2-prop-2-enylpentanedioic acid diethyl ester Diethyl 2-allyl-3-oxo-pentanedioate Diethyl 3-oxidanylidene-2-prop-2-enyl-pentanedioate Diethyl 3-oxo-2-prop-2-enylpentanedioate
Wiley ID 1244838