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

*Links on SpectraBase are not permalinks.

MDKBXYPRMUMUME-UHFFFAOYSA-N

View entire compound with spectra: 3 NMR, and 2 MS (GC)

MDKBXYPRMUMUME-UHFFFAOYSA-N
SpectraBase Compound ID 4GIJBV3egrJ
InChI InChI=1S/C7H9NO/c1-5-3-4-6(2)8-7(5)9/h3-4H,1-2H3,(H,8,9)
InChIKey MDKBXYPRMUMUME-UHFFFAOYSA-N
Mol Weight 123.15 g/mol
Molecular Formula C7H9NO
Exact Mass 123.068414 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 KFlrJE3ulpb
Name 2(1H)-Pyridinone, 3,6-dimethyl-
Alternate Name(s) 3,6-Dimethyl-2(1H)-pyridinone 3,6-Dimethylpyridin-2-ol 3,6-Dimethylpyridin-2(1H)-one 3,6-Dimethyl-1H-pyridin-2-one 3,6-Dimethyl-2-pyridone
CAS Registry Number 53428-02-7
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9NO
InChI InChI=1S/C7H9NO/c1-5-3-4-6(2)8-7(5)9/h3-4H,1-2H3,(H,8,9)
InChIKey MDKBXYPRMUMUME-UHFFFAOYSA-N
Molecular Weight 123.155 g/mol
SMILES N1C(C(=CC=C1C)C)=O
SPLASH splash10-00dl-9300000000-de665f6fabbeef95bd39
Wiley ID 1478614