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Methyl 2-[3-(Ethoxycarbonyl)bicyclo[3.1.0]hex-1-yl]propenoate
SpectraBase Compound ID 3SAyuxaOYUl
InChI InChI=1S/C13H18O4/c1-4-17-12(15)9-5-10-7-13(10,6-9)8(2)11(14)16-3/h9-10H,2,4-7H2,1,3H3
InChIKey JKCAXMLEYOFWPE-UHFFFAOYSA-N
Mol Weight 238.28 g/mol
Molecular Formula C13H18O4
Exact Mass 238.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gruv0tb6BeG
Name Methyl 2-[3-(Ethoxycarbonyl)bicyclo[3.1.0]hex-1-yl]propenoate
Comments Removed - expert review: contamination (CCl4); A corrected record has been addded having SpectrumID: 1821460
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O4
InChI InChI=1S/C13H18O4/c1-4-17-12(15)9-5-10-7-13(10,6-9)8(2)11(14)16-3/h9-10H,2,4-7H2,1,3H3
InChIKey JKCAXMLEYOFWPE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200606155
Molecular Weight 238.283 g/mol
SMILES C(C(=C)C12CC(CC1C2)C(=O)OCC)(=O)OC
SPLASH splash10-0aor-2900000000-eda6461e6fafc58d5d66
Source of Spectrum ASC-348-2133/SM8-2d
Synonyms Ethyl 1-(3-methoxy-3-oxoprop-1-en-2-yl)bicyclo[3.1.0]hexane-3-carboxylate 1-(3-methoxy-3-oxoprop-1-en-2-yl)-3-bicyclo[3.1.0]hexanecarboxylic acid ethyl ester Ethyl 1-(1-methoxycarbonylvinyl)bicyclo[3.1.0]hexane-3-carboxylate Ethyl 1-(3-methoxy-3-oxidanylidene-prop-1-en-2-yl)bicyclo[3.1.0]hexane-3-carboxylate
Wiley ID 1765013