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

*Links on SpectraBase are not permalinks.

1-Phenyl-1,3-butanedione

View entire compound with spectra: 1 NMR

1-Phenyl-1,3-butanedione
SpectraBase Compound ID 3jSzYTNZTwy
InChI InChI=1S/2C10H10O2/c2*1-8(11)7-10(12)9-5-3-2-4-6-9/h2-6H,7H2,1H3;2-7,12H,1H3/b;10-7-
InChIKey WSXIJOKZCDFICY-QYCSVTBISA-N
Mol Weight 162.19 g/mol
Molecular Formula C10H10O2
Exact Mass 162.06808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID HyvWrW8gTEm
Name 1-PHENYL-1,3-BUTANEDIONE
Source of Sample Eastman Organic Chemicals, Rochester, New York
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O2
InChI InChI=1S/2C10H10O2/c2*1-8(11)7-10(12)9-5-3-2-4-6-9/h2-6H,7H2,1H3;2-7,12H,1H3/b;10-7-
InChIKey WSXIJOKZCDFICY-QYCSVTBISA-N
Melting Point 57-58C
Molecular Weight 162.19
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian HA-100/Digilab FT-NMR-3
Synonyms BUTYROPHENONE, 3-OXO-, 1,3-BUTANEDIONE, 1-PHENYL-,