CID 135753903

81342-98-5

Structural Information

Molecular Formula
C15H17ClN4O
SMILES
CCN(CC)C1=CC(=C(C=C1)N=NC2=NC=C(C=C2)Cl)O
InChI
InChI=1S/C15H17ClN4O/c1-3-20(4-2)12-6-7-13(14(21)9-12)18-19-15-8-5-11(16)10-17-15/h5-10,21H,3-4H2,1-2H3
InChIKey
AVFMWWZNELCFKL-UHFFFAOYSA-N
Compound name
2-[(5-chloropyridin-2-yl)diazenyl]-5-(diethylamino)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

304.1091 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.11638 170.2
[M+Na]+ 327.09832 184.1
[M+NH4]+ 322.14292 178.2
[M+K]+ 343.07226 175.8
[M-H]- 303.10182 176.3
[M+Na-2H]- 325.08377 179.7
[M]+ 304.10855 174.1
[M]- 304.10965 174.1
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