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Methyl (2E)-3-(5-methylfuran-2-yl)hept-2-enoate
SpectraBase Compound ID 5iaG4yzwNSM
InChI InChI=1S/C13H18O3/c1-4-5-6-11(9-13(14)15-3)12-8-7-10(2)16-12/h7-9H,4-6H2,1-3H3/b11-9+
InChIKey BRZSYXDPALGOOA-PKNBQFBNSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kl4bwtHUJTu
Name Methyl (2E)-3-(5-methylfuran-2-yl)hept-2-enoate
Alternate Name(s) (E)-methyl 3-(5-methylfuran-2-yl)hept-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-4-5-6-11(9-13(14)15-3)12-8-7-10(2)16-12/h7-9H,4-6H2,1-3H3/b11-9+
InChIKey BRZSYXDPALGOOA-PKNBQFBNSA-N
Literature Reference DOI 10.1002/adsc.200900402
Molecular Weight 222.284 g/mol
SMILES C(\C=C/(CCCC)c1oc(cc1)C)(=O)OC
SPLASH splash10-0089-1910000000-0138bc7b067673d263db
Source of Spectrum ASC-351-2475-8d
Wiley ID 1763452