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3,5-Heptanedione, 2,6-dimethyl-4-(phenylmethylene)-

View entire compound with spectra: 1 MS (GC)

3,5-Heptanedione, 2,6-dimethyl-4-(phenylmethylene)-
SpectraBase Compound ID 4FSM1nPXfL3
InChI InChI=1S/C16H20O2/c1-11(2)15(17)14(16(18)12(3)4)10-13-8-6-5-7-9-13/h5-12H,1-4H3
InChIKey PUBYOXPNVPTJCU-UHFFFAOYSA-N
Mol Weight 244.33 g/mol
Molecular Formula C16H20O2
Exact Mass 244.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KccwASmY69S
Name 3,5-Heptanedione, 2,6-dimethyl-4-(phenylmethylene)-
Alternate Name(s) 4-Benzylidene-2,6-dimethyl-3,5-heptanedione Benzylidene-2,6-dimethyl-3,5-heptanedione
CAS Registry Number 132541-73-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O2
InChI InChI=1S/C16H20O2/c1-11(2)15(17)14(16(18)12(3)4)10-13-8-6-5-7-9-13/h5-12H,1-4H3
InChIKey PUBYOXPNVPTJCU-UHFFFAOYSA-N
Molecular Weight 244.334 g/mol
SMILES C(C(=O)C(C)C)(C(=O)C(C)C)=Cc1ccccc1
SPLASH splash10-0ul0-9750000000-f04cc5a7494f798169dd
Source of Spectrum C-113-2227-6
Wiley ID 1247464