CID 94626

68214-81-3

Structural Information

Molecular Formula
C17H21N3O
SMILES
CCN(CCO)C1=CC(=C(C=C1)N=NC2=CC=CC=C2)C
InChI
InChI=1S/C17H21N3O/c1-3-20(11-12-21)16-9-10-17(14(2)13-16)19-18-15-7-5-4-6-8-15/h4-10,13,21H,3,11-12H2,1-2H3
InChIKey
WWWQBYPZQKGTLA-UHFFFAOYSA-N
Compound name
2-(N-ethyl-3-methyl-4-phenyldiazenylanilino)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.16846 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.17574 167.4
[M+Na]+ 306.15768 172.8
[M-H]- 282.16118 176.6
[M+NH4]+ 301.20228 183.6
[M+K]+ 322.13162 170.4
[M+H-H2O]+ 266.16572 158.0
[M+HCOO]- 328.16666 196.2
[M+CH3COO]- 342.18231 214.7
[M+Na-2H]- 304.14313 173.2
[M]+ 283.16791 169.9
[M]- 283.16901 169.9
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.