CID 47684

65587-38-4

Structural Information

Molecular Formula
C15H15N3O2
SMILES
CN(CC1=CC=CC=C1)N=NC2=CC=C(C=C2)C(=O)O
InChI
InChI=1S/C15H15N3O2/c1-18(11-12-5-3-2-4-6-12)17-16-14-9-7-13(8-10-14)15(19)20/h2-10H,11H2,1H3,(H,19,20)
InChIKey
MBZDFRQDGNXUKS-UHFFFAOYSA-N
Compound name
4-[[benzyl(methyl)amino]diazenyl]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

269.11642 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.12370 162.3
[M+Na]+ 292.10564 174.0
[M+NH4]+ 287.15024 169.9
[M+K]+ 308.07958 167.3
[M-H]- 268.10914 168.2
[M+Na-2H]- 290.09109 171.8
[M]+ 269.11587 165.4
[M]- 269.11697 165.4
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

No patent data available for this compound.