CID 376615

Nsc657646

Structural Information

Molecular Formula
C15H11N3O2
SMILES
C1=CC=C2C(=C1)C(=CC(=C2N=O)O)NC3=CN=CC=C3
InChI
InChI=1S/C15H11N3O2/c19-14-8-13(17-10-4-3-7-16-9-10)11-5-1-2-6-12(11)15(14)18-20/h1-9,17,19H
InChIKey
VRYAIKWDPUUMIG-UHFFFAOYSA-N
Compound name
1-nitroso-4-(pyridin-3-ylamino)naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.0851 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.092376 156.2
[M+Na]+ 288.074318 165.0
[M-H]- 264.077824 163.1
[M+NH4]+ 283.118923 171.7
[M+K]+ 304.048258 160.5
[M+H-H2O]+ 248.082360 147.2
[M+HCOO]- 310.083301 181.4
[M+CH3COO]- 324.098951 168.7
[M+Na-2H]- 286.059766 166.0
[M]+ 265.08455142 156.9
[M]- 265.08564858 156.9
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.