CID 454357

145901-87-7

Structural Information

Molecular Formula
C15H18N2O2
SMILES
CCC1=C(NC(=O)C(=C1)NCC2=CC=CC=C2O)C
InChI
InChI=1S/C15H18N2O2/c1-3-11-8-13(15(19)17-10(11)2)16-9-12-6-4-5-7-14(12)18/h4-8,16,18H,3,9H2,1-2H3,(H,17,19)
InChIKey
GJJTWMJKJHXXIQ-UHFFFAOYSA-N
Compound name
5-ethyl-3-[(2-hydroxyphenyl)methylamino]-6-methyl-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

258.13684 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.14412 159.5
[M+Na]+ 281.12606 167.9
[M-H]- 257.12956 162.9
[M+NH4]+ 276.17066 173.9
[M+K]+ 297.10000 162.3
[M+H-H2O]+ 241.13410 151.7
[M+HCOO]- 303.13504 180.8
[M+CH3COO]- 317.15069 195.7
[M+Na-2H]- 279.11151 163.6
[M]+ 258.13629 158.8
[M]- 258.13739 158.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.