CID 578991

3-(ethylamino)phenol

Structural Information

Molecular Formula
C8H11NO
SMILES
CCNC1=CC(=CC=C1)O
InChI
InChI=1S/C8H11NO/c1-2-9-7-4-3-5-8(10)6-7/h3-6,9-10H,2H2,1H3
InChIKey
TVKZDKSHNITMRZ-UHFFFAOYSA-N
Compound name
3-(ethylamino)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

342
Patents

137.08406 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.09134 127.1
[M+Na]+ 160.07328 139.4
[M+NH4]+ 155.11788 136.1
[M+K]+ 176.04722 132.9
[M-H]- 136.07678 129.8
[M+Na-2H]- 158.05873 134.6
[M]+ 137.08351 129.5
[M]- 137.08461 129.5
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