CID 79927

4,6-bis(phenylazo)-o-cresol

Structural Information

Molecular Formula
C19H16N4O
SMILES
CC1=CC(=CC(=C1O)N=NC2=CC=CC=C2)N=NC3=CC=CC=C3
InChI
InChI=1S/C19H16N4O/c1-14-12-17(22-20-15-8-4-2-5-9-15)13-18(19(14)24)23-21-16-10-6-3-7-11-16/h2-13,24H,1H3
InChIKey
RPZZLBYXHLWEOJ-UHFFFAOYSA-N
Compound name
2-methyl-4,6-bis(phenyldiazenyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

316.13242 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.13970 176.5
[M+Na]+ 339.12164 191.6
[M+NH4]+ 334.16624 185.3
[M+K]+ 355.09558 181.6
[M-H]- 315.12514 186.9
[M+Na-2H]- 337.10709 189.9
[M]+ 316.13187 181.6
[M]- 316.13297 181.6
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