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]+ 284.175736 167.4
[M+Na]+ 306.157678 172.8
[M-H]- 282.161184 176.6
[M+NH4]+ 301.202283 183.6
[M+K]+ 322.131618 170.4
[M+H-H2O]+ 266.165720 158.0
[M+HCOO]- 328.166661 196.2
[M+CH3COO]- 342.182311 214.7
[M+Na-2H]- 304.143126 173.2
[M]+ 283.16791142 169.9
[M]- 283.16900858 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.