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Methyl (2E)-3-(2,2,6-trimethyl-5-oxo-7-oxabicyclo[4.1.0]hept-1-yl)-2-propenoate
SpectraBase Compound ID EHt0CEmq6Rd
InChI InChI=1S/C13H18O4/c1-11(2)7-5-9(14)12(3)13(11,17-12)8-6-10(15)16-4/h6,8H,5,7H2,1-4H3/b8-6+
InChIKey HPZVKTBLYLSQKE-SOFGYWHQSA-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 5tAi0pEgJzX
Name Methyl (2E)-3-(2,2,6-trimethyl-5-oxo-7-oxabicyclo[4.1.0]hept-1-yl)-2-propenoate
CAS Registry Number 70412-63-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O4
InChI InChI=1S/C13H18O4/c1-11(2)7-5-9(14)12(3)13(11,17-12)8-6-10(15)16-4/h6,8H,5,7H2,1-4H3/b8-6+
InChIKey HPZVKTBLYLSQKE-SOFGYWHQSA-N
Molecular Weight 238.283 g/mol
SMILES C12(C(=O)CCC(C2(O1)\C=C\C(=O)OC)(C)C)C
SPLASH splash10-000l-3900000000-2a6b436e42d75e79d7b2
Source of Spectrum H-62-572-0
Synonyms (E)-3-(1,5,5-trimethyl-2-oxo-7-oxabicyclo[4.1.0]heptan-6-yl)-2-propenoic acid methyl ester (E)-3-(2-keto-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-6-yl)acrylic acid methyl ester 3-(2,2,6-Trimethyl-5-oxo-7-oxa-bicyclo[4.1.0]hept-1-yl)-acrylic acid, methyl ester Methyl (E)-3-(1,5,5-trimethyl-2-oxidanylidene-7-oxabicyclo[4.1.0]heptan-6-yl)prop-2-enoate Methyl (E)-3-(1,5,5-trimethyl-2-oxo-7-oxabicyclo[4.1.0]heptan-6-yl)prop-2-enoate
Wiley ID 1240474