CID 494305

Nsc377903

Structural Information

Molecular Formula
C16H12N4O
SMILES
COC1=CC2=C(C=C1)N=C(C=C2N=[N+]=[N-])C3=CC=CC=C3
InChI
InChI=1S/C16H12N4O/c1-21-12-7-8-14-13(9-12)16(19-20-17)10-15(18-14)11-5-3-2-4-6-11/h2-10H,1H3
InChIKey
WQKUKUQTFFKVRI-UHFFFAOYSA-N
Compound name
4-azido-6-methoxy-2-phenylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

276.1011 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.10838 160.3
[M+Na]+ 299.09032 168.1
[M-H]- 275.09382 169.3
[M+NH4]+ 294.13492 175.8
[M+K]+ 315.06426 159.0
[M+H-H2O]+ 259.09836 154.7
[M+HCOO]- 321.09930 189.2
[M+CH3COO]- 335.11495 204.0
[M+Na-2H]- 297.07577 172.3
[M]+ 276.10055 159.7
[M]- 276.10165 159.7
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.