For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-(Phenylmethylene)heptane-3,5-dione
SpectraBase Compound ID 3qXXwmWjstw
InChI InChI=1S/C14H16O2/c1-3-13(15)12(14(16)4-2)10-11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3
InChIKey FFQGEUIUXKLSJM-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2zkLT2IwhiO
Name 4-(Phenylmethylene)heptane-3,5-dione
Alternate Name(s) 4-(Phenylmethylidene)heptane-3,5-dione 4-Benzalheptane-3,5-dione 4-Benzylideneheptane-3,5-dione
CAS Registry Number 57711-74-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O2
InChI InChI=1S/C14H16O2/c1-3-13(15)12(14(16)4-2)10-11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3
InChIKey FFQGEUIUXKLSJM-UHFFFAOYSA-N
Molecular Weight 216.280 g/mol
SMILES C(=Cc1ccccc1)(C(=O)CC)C(=O)CC
SPLASH splash10-0a59-8910000000-cb513a51189a6b592e72
Source of Spectrum C-113-2227-5
Wiley ID 1215908