CID 18386

Sudan ii

Structural Information

Molecular Formula
C18H16N2O
SMILES
CC1=CC(=C(C=C1)N=NC2=C(C=CC3=CC=CC=C32)O)C
InChI
InChI=1S/C18H16N2O/c1-12-7-9-16(13(2)11-12)19-20-18-15-6-4-3-5-14(15)8-10-17(18)21/h3-11,21H,1-2H3
InChIKey
JBTHDAVBDKKSRW-UHFFFAOYSA-N
Compound name
1-[(2,4-dimethylphenyl)diazenyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

95
References

9856
Patents

276.12625 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.13353 164.4
[M+Na]+ 299.11547 180.7
[M+NH4]+ 294.16007 174.3
[M+K]+ 315.08941 171.0
[M-H]- 275.11897 172.2
[M+Na-2H]- 297.10092 175.1
[M]+ 276.12570 169.2
[M]- 276.12680 169.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe