CID 66713

2-(4-amino-n-ethylanilino)ethanol

Structural Information

Molecular Formula
C10H16N2O
SMILES
CCN(CCO)C1=CC=C(C=C1)N
InChI
InChI=1S/C10H16N2O/c1-2-12(7-8-13)10-5-3-9(11)4-6-10/h3-6,13H,2,7-8,11H2,1H3
InChIKey
WFXLRLQSHRNHCE-UHFFFAOYSA-N
Compound name
2-(4-amino-N-ethylanilino)ethanol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

8085
Patents

180.12627 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.133546 140.4
[M+Na]+ 203.115488 146.3
[M-H]- 179.118994 143.6
[M+NH4]+ 198.160093 159.7
[M+K]+ 219.089428 144.7
[M+H-H2O]+ 163.123530 133.9
[M+HCOO]- 225.124471 165.3
[M+CH3COO]- 239.140121 187.5
[M+Na-2H]- 201.100936 145.6
[M]+ 180.12572142 139.3
[M]- 180.12681858 139.3
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

patents stripe