CID 16966

4-methoxyazobenzene

Structural Information

Molecular Formula
C13H12N2O
SMILES
COC1=CC=C(C=C1)N=NC2=CC=CC=C2
InChI
InChI=1S/C13H12N2O/c1-16-13-9-7-12(8-10-13)15-14-11-5-3-2-4-6-11/h2-10H,1H3
InChIKey
LGCRPKOHRIXSEG-UHFFFAOYSA-N
Compound name
(4-methoxyphenyl)-phenyldiazene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

233
Patents

212.09496 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.10224 144.4
[M+Na]+ 235.08418 151.9
[M-H]- 211.08768 154.0
[M+NH4]+ 230.12878 163.7
[M+K]+ 251.05812 149.8
[M+H-H2O]+ 195.09222 136.1
[M+HCOO]- 257.09316 174.7
[M+CH3COO]- 271.10881 195.7
[M+Na-2H]- 233.06963 154.0
[M]+ 212.09441 146.5
[M]- 212.09551 146.5
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