CID 30687

21554-20-1

Structural Information

Molecular Formula
C14H15N3O
SMILES
CC1=CC(=CC(=C1O)C)N=NC2=CC=C(C=C2)N
InChI
InChI=1S/C14H15N3O/c1-9-7-13(8-10(2)14(9)18)17-16-12-5-3-11(15)4-6-12/h3-8,18H,15H2,1-2H3
InChIKey
JZWYCRKVXZLMRK-UHFFFAOYSA-N
Compound name
4-[(4-aminophenyl)diazenyl]-2,6-dimethylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.1215 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.128776 154.3
[M+Na]+ 264.110718 162.9
[M-H]- 240.114224 162.9
[M+NH4]+ 259.155323 172.0
[M+K]+ 280.084658 159.5
[M+H-H2O]+ 224.118760 146.3
[M+HCOO]- 286.119701 183.0
[M+CH3COO]- 300.135351 204.1
[M+Na-2H]- 262.096166 159.9
[M]+ 241.12095142 154.4
[M]- 241.12204858 154.4
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