CID 163730

104226-21-3

Structural Information

Molecular Formula
C17H22N4O2
SMILES
CC1=C(C=CC(=C1)N(CCO)CCO)N=NC2=CC=C(C=C2)N
InChI
InChI=1S/C17H22N4O2/c1-13-12-16(21(8-10-22)9-11-23)6-7-17(13)20-19-15-4-2-14(18)3-5-15/h2-7,12,22-23H,8-11,18H2,1H3
InChIKey
YSVKKVUAUKQDBY-UHFFFAOYSA-N
Compound name
2-[4-[(4-aminophenyl)diazenyl]-N-(2-hydroxyethyl)-3-methylanilino]ethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

2452
Patents

314.1743 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.181576 173.9
[M+Na]+ 337.163518 178.8
[M-H]- 313.167024 181.5
[M+NH4]+ 332.208123 187.7
[M+K]+ 353.137458 176.1
[M+H-H2O]+ 297.171560 164.4
[M+HCOO]- 359.172501 201.8
[M+CH3COO]- 373.188151 220.3
[M+Na-2H]- 335.148966 178.1
[M]+ 314.17375142 174.7
[M]- 314.17484858 174.7
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

patents stripe