CID 47670

65542-20-3

Structural Information

Molecular Formula
C19H23N3O2
SMILES
CC(C)(C)C1=CC=C(C=C1)CN(C)N=NC2=CC=C(C=C2)C(=O)O
InChI
InChI=1S/C19H23N3O2/c1-19(2,3)16-9-5-14(6-10-16)13-22(4)21-20-17-11-7-15(8-12-17)18(23)24/h5-12H,13H2,1-4H3,(H,23,24)
InChIKey
YPWNPYJNMLENNZ-UHFFFAOYSA-N
Compound name
4-[[(4-tert-butylphenyl)methyl-methylamino]diazenyl]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.17902 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.18630 179.7
[M+Na]+ 348.16824 190.6
[M+NH4]+ 343.21284 186.4
[M+K]+ 364.14218 184.5
[M-H]- 324.17174 184.9
[M+Na-2H]- 346.15369 187.9
[M]+ 325.17847 182.6
[M]- 325.17957 182.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.