CID 135443555

Nsc168467

Structural Information

Molecular Formula
C17H15N3O
SMILES
CN(C1=NC2=CC=CC=C2C=C1)/N=C/C3=CC=CC=C3O
InChI
InChI=1S/C17H15N3O/c1-20(18-12-14-7-3-5-9-16(14)21)17-11-10-13-6-2-4-8-15(13)19-17/h2-12,21H,1H3/b18-12+
InChIKey
CFYWZXMOVDVVDV-LDADJPATSA-N
Compound name
2-[(E)-[methyl(quinolin-2-yl)hydrazinylidene]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

277.12152 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.12880 162.6
[M+Na]+ 300.11074 169.9
[M-H]- 276.11424 170.2
[M+NH4]+ 295.15534 178.1
[M+K]+ 316.08468 165.6
[M+H-H2O]+ 260.11878 153.0
[M+HCOO]- 322.11972 187.4
[M+CH3COO]- 336.13537 174.5
[M+Na-2H]- 298.09619 171.2
[M]+ 277.12097 163.2
[M]- 277.12207 163.2
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

No patent data available for this compound.