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

15330
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]+ 385.25981 198.0
[M+Na]+ 407.24175 201.6
[M-H]- 383.24525 206.8
[M+NH4]+ 402.28635 209.9
[M+K]+ 423.21569 199.6
[M+H-H2O]+ 367.24979 187.4
[M+HCOO]- 429.25073 225.0
[M+CH3COO]- 443.26638 240.2
[M+Na-2H]- 405.22720 198.9
[M]+ 384.25198 203.0
[M]- 384.25308 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.