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(E)-3-((2-(3-methylbenzylidene)cyclopropyl)methylene)pentane-2,4-dione
SpectraBase Compound ID AG1KpsRpLOy
InChI InChI=1S/C17H18O2/c1-11-5-4-6-14(7-11)8-15-9-16(15)10-17(12(2)18)13(3)19/h4-8,10,16H,9H2,1-3H3/b15-8+
InChIKey BACXHGIQRXMGGT-OVCLIPMQSA-N
Mol Weight 254.33 g/mol
Molecular Formula C17H18O2
Exact Mass 254.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LT6yKbMZhGm
Name (E)-3-((2-(3-methylbenzylidene)cyclopropyl)methylene)pentane-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2
InChI InChI=1S/C17H18O2/c1-11-5-4-6-14(7-11)8-15-9-16(15)10-17(12(2)18)13(3)19/h4-8,10,16H,9H2,1-3H3/b15-8+
InChIKey BACXHGIQRXMGGT-OVCLIPMQSA-N
Literature Reference DOI 10.1021/ol102002f
Molecular Weight 254.329 g/mol
SMILES c1ccc(\C=C/2CC2C=C(C(C)=O)C(=O)C)cc1C
SPLASH splash10-0udl-4490000000-663ba395abf91211596a
Source of Spectrum A1-12-5120/SMS12-1g
Wiley ID 1752606