CID 3776068

31107-06-9

Structural Information

Molecular Formula
C14H10N4O3
SMILES
C1=CC=C2C(=C1)C(=C(N2)O)N=NC3=CC=C(C=C3)[N+](=O)[O-]
InChI
InChI=1S/C14H10N4O3/c19-14-13(11-3-1-2-4-12(11)15-14)17-16-9-5-7-10(8-6-9)18(20)21/h1-8,15,19H
InChIKey
HHJYHWPKXWRLIE-UHFFFAOYSA-N
Compound name
3-[(4-nitrophenyl)diazenyl]-1H-indol-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

282.0753 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.08258 158.9
[M+Na]+ 305.06452 172.9
[M+NH4]+ 300.10912 166.5
[M+K]+ 321.03846 170.4
[M-H]- 281.06802 164.9
[M+Na-2H]- 303.04997 167.4
[M]+ 282.07475 162.3
[M]- 282.07585 162.3
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

patents stripe