CID 10856926

139122-76-2

Structural Information

Molecular Formula
C12H15N3O
SMILES
CN(C1=CC=CC=C1)NC2=CC(=O)NCC2
InChI
InChI=1S/C12H15N3O/c1-15(11-5-3-2-4-6-11)14-10-7-8-13-12(16)9-10/h2-6,9,14H,7-8H2,1H3,(H,13,16)
InChIKey
AHRRHWGQOOPSSZ-UHFFFAOYSA-N
Compound name
4-(2-methyl-2-phenylhydrazinyl)-2,3-dihydro-1H-pyridin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

217.1215 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.128776 147.5
[M+Na]+ 240.110718 152.1
[M-H]- 216.114224 152.3
[M+NH4]+ 235.155323 163.5
[M+K]+ 256.084658 149.2
[M+H-H2O]+ 200.118760 139.0
[M+HCOO]- 262.119701 169.9
[M+CH3COO]- 276.135351 192.3
[M+Na-2H]- 238.096166 153.7
[M]+ 217.12095142 142.6
[M]- 217.12204858 142.6
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

patents stripe