CID 135781034

765909-06-6

Structural Information

Molecular Formula
C18H15N3O2
SMILES
CC1=CC=CC=C1C(=O)N/N=C/C2=CC3=CC=CC=C3NC2=O
InChI
InChI=1S/C18H15N3O2/c1-12-6-2-4-8-15(12)18(23)21-19-11-14-10-13-7-3-5-9-16(13)20-17(14)22/h2-11H,1H3,(H,20,22)(H,21,23)/b19-11+
InChIKey
IKFQWYXVMGQIKU-YBFXNURJSA-N
Compound name
2-methyl-N-[(E)-(2-oxo-1H-quinolin-3-yl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.11642 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.123696 169.4
[M+Na]+ 328.105638 177.2
[M-H]- 304.109144 175.9
[M+NH4]+ 323.150243 183.2
[M+K]+ 344.079578 171.4
[M+H-H2O]+ 288.113680 160.0
[M+HCOO]- 350.114621 192.8
[M+CH3COO]- 364.130271 209.3
[M+Na-2H]- 326.091086 176.3
[M]+ 305.11587142 168.9
[M]- 305.11696858 168.9
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.