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Ethyl (2E)-7-(1,3-benzodioxol-5-yl)-2-heptenoate
SpectraBase Compound ID LsEv34EQQDZ
InChI InChI=1S/C16H20O4/c1-2-18-16(17)8-6-4-3-5-7-13-9-10-14-15(11-13)20-12-19-14/h6,8-11H,2-5,7,12H2,1H3/b8-6+
InChIKey URQDQRGYQQKZOF-SOFGYWHQSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J8PCyu4t81o
Name Ethyl (2E)-7-(1,3-benzodioxol-5-yl)-2-heptenoate
CAS Registry Number 83029-44-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-2-18-16(17)8-6-4-3-5-7-13-9-10-14-15(11-13)20-12-19-14/h6,8-11H,2-5,7,12H2,1H3/b8-6+
InChIKey URQDQRGYQQKZOF-SOFGYWHQSA-N
Molecular Weight 276.332 g/mol
SMILES CCOC(=O)\C=C\CCCCc1cc2c(OCO2)cc1
SPLASH splash10-002r-0940000000-153c4b926dac3d149edf
Source of Spectrum W5-1989-34482-31054
Synonyms (E)-7-(1,3-benzodioxol-5-yl)-2-heptenoic acid ethyl ester (E)-7-(1,3-benzodioxol-5-yl)hept-2-enoic acid ethyl ester Ethyl (2E)-7-(3,4-methylenedioxyphenyl)hept-2-enoate Ethyl (E)-7-(1,3-benzodioxol-5-yl)hept-2-enoate
Wiley ID 1280152