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]+ 306.12370 169.4
[M+Na]+ 328.10564 177.2
[M-H]- 304.10914 175.9
[M+NH4]+ 323.15024 183.2
[M+K]+ 344.07958 171.4
[M+H-H2O]+ 288.11368 160.0
[M+HCOO]- 350.11462 192.8
[M+CH3COO]- 364.13027 209.3
[M+Na-2H]- 326.09109 176.3
[M]+ 305.11587 168.9
[M]- 305.11697 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.