CID 5218788

6-methyl-2-(phenylazo)-3-pyridinol

Structural Information

Molecular Formula
C12H11N3O
SMILES
CC1=NC(=C(C=C1)O)N=NC2=CC=CC=C2
InChI
InChI=1S/C12H11N3O/c1-9-7-8-11(16)12(13-9)15-14-10-5-3-2-4-6-10/h2-8,16H,1H3
InChIKey
LOCPVWIREQIGNQ-UHFFFAOYSA-N
Compound name
6-methyl-2-phenyldiazenylpyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

36
References

387
Patents

213.09021 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.097486 144.9
[M+Na]+ 236.079428 153.3
[M-H]- 212.082934 152.2
[M+NH4]+ 231.124033 162.4
[M+K]+ 252.053368 150.4
[M+H-H2O]+ 196.087470 136.3
[M+HCOO]- 258.088411 172.7
[M+CH3COO]- 272.104061 193.8
[M+Na-2H]- 234.064876 154.0
[M]+ 213.08966142 145.6
[M]- 213.09075858 145.6
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