CID 135407190

Nsc-205499

Structural Information

Molecular Formula
C19H16N2O2
SMILES
CC1=CC=C(C=C1)C(=O)N/N=C/C2=C(C=CC3=CC=CC=C32)O
InChI
InChI=1S/C19H16N2O2/c1-13-6-8-15(9-7-13)19(23)21-20-12-17-16-5-3-2-4-14(16)10-11-18(17)22/h2-12,22H,1H3,(H,21,23)/b20-12+
InChIKey
KLWGWMIYMVGVJR-UDWIEESQSA-N
Compound name
N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]-4-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

2
Patents

304.1212 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.12848 171.7
[M+Na]+ 327.11042 186.0
[M+NH4]+ 322.15502 180.0
[M+K]+ 343.08436 177.5
[M-H]- 303.11392 177.9
[M+Na-2H]- 325.09587 180.8
[M]+ 304.12065 175.5
[M]- 304.12175 175.5
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