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(E)-methyl 1-acetyl-2-benzylidene-cyclopentanecarboxylate
SpectraBase Compound ID L2nlw5dvPSG
InChI InChI=1S/C16H18O3/c1-12(17)16(15(18)19-2)10-6-9-14(16)11-13-7-4-3-5-8-13/h3-5,7-8,11H,6,9-10H2,1-2H3/b14-11+
InChIKey QCOBFIYQHIOVHH-SDNWHVSQSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34cXlFDWRE
Name (E)-methyl 1-acetyl-2-benzylidene-cyclopentanecarboxylate
Alternate Name(s) Methyl (E)-1-acetyl-2-benzylidenecyclopentane-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-12(17)16(15(18)19-2)10-6-9-14(16)11-13-7-4-3-5-8-13/h3-5,7-8,11H,6,9-10H2,1-2H3/b14-11+
InChIKey QCOBFIYQHIOVHH-SDNWHVSQSA-N
Literature Reference DOI 10.1002/adsc.201600175
Molecular Weight 258.317 g/mol
SMILES C1(\C(CCC1)=C\c1ccccc1)(C(=O)OC)C(=O)C
SPLASH splash10-069u-3920000000-fd54a29f9a664fb325a6
Source of Spectrum ASC-358-1824-2
Wiley ID 1800710