CID 91719492

Azo dye

Structural Information

Molecular Formula
C22H32N4O2
SMILES
CCN(CCO)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)N(CC)CCO)C)C
InChI
InChI=1S/C22H32N4O2/c1-5-25(11-13-27)19-7-9-21(17(3)15-19)23-24-22-10-8-20(16-18(22)4)26(6-2)12-14-28/h7-10,15-16,27-28H,5-6,11-14H2,1-4H3
InChIKey
UQACKAULSXYLJH-UHFFFAOYSA-N
Compound name
2-[N-ethyl-4-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]diazenyl]-3-methylanilino]ethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

15342
References

0
Patents

384.25253 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.259806 198.0
[M+Na]+ 407.241748 201.6
[M-H]- 383.245254 206.8
[M+NH4]+ 402.286353 209.9
[M+K]+ 423.215688 199.6
[M+H-H2O]+ 367.249790 187.4
[M+HCOO]- 429.250731 225.0
[M+CH3COO]- 443.266381 240.2
[M+Na-2H]- 405.227196 198.9
[M]+ 384.25198142 203.0
[M]- 384.25307858 203.0
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.