CID 623889

967-13-5

Structural Information

Molecular Formula
C17H12N2O2
SMILES
C1=CC=C2C(=C1)C=CC=C2N=CC3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C17H12N2O2/c20-19(21)15-10-8-13(9-11-15)12-18-17-7-3-5-14-4-1-2-6-16(14)17/h1-12H
InChIKey
QDPIWAUWWLKADK-UHFFFAOYSA-N
Compound name
N-naphthalen-1-yl-1-(4-nitrophenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.08987 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.09715 160.8
[M+Na]+ 299.07909 167.3
[M-H]- 275.08259 169.5
[M+NH4]+ 294.12369 176.9
[M+K]+ 315.05303 158.7
[M+H-H2O]+ 259.08713 156.5
[M+HCOO]- 321.08807 187.4
[M+CH3COO]- 335.10372 198.5
[M+Na-2H]- 297.06454 170.6
[M]+ 276.08932 159.5
[M]- 276.09042 159.5
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.