CID 292248

1,2,6-trimethyl-4(1h)-pyridinone

Structural Information

Molecular Formula
C8H11NO
SMILES
CC1=CC(=O)C=C(N1C)C
InChI
InChI=1S/C8H11NO/c1-6-4-8(10)5-7(2)9(6)3/h4-5H,1-3H3
InChIKey
KXVUMEAPZKTOCS-UHFFFAOYSA-N
Compound name
1,2,6-trimethylpyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

137.08406 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.09134 125.9
[M+Na]+ 160.07328 140.7
[M+NH4]+ 155.11788 134.7
[M+K]+ 176.04722 134.1
[M-H]- 136.07678 128.0
[M+Na-2H]- 158.05873 133.4
[M]+ 137.08351 128.7
[M]- 137.08461 128.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe