CID 117786

Basic brown 16

Structural Information

Molecular Formula
C19H21N4O
SMILES
C[N+](C)(C)C1=CC2=C(C=C1)C=CC(=C2N=NC3=CC=C(C=C3)N)O
InChI
InChI=1S/C19H20N4O/c1-23(2,3)16-10-4-13-5-11-18(24)19(17(13)12-16)22-21-15-8-6-14(20)7-9-15/h4-12H,1-3H3,(H2-,20,21,22,24)/p+1
InChIKey
KZDKDLDVQWZTRZ-UHFFFAOYSA-O
Compound name
[8-[(4-aminophenyl)diazenyl]-7-hydroxynaphthalen-2-yl]-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

5636
Patents

321.17154 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.17882 174.4
[M+Na]+ 344.16076 189.9
[M+NH4]+ 339.20536 184.3
[M+K]+ 360.13470 182.3
[M-H]- 320.16426 184.1
[M+Na-2H]- 342.14621 185.3
[M]+ 321.17099 179.9
[M]- 321.17209 179.9
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

patents stripe