CID 22174

4-(dimethylamino)phenol

Structural Information

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

2D Structure

compound 2d structure
5
Annotation Hits

71
References

18995
Patents

137.08406 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.09134 126.5
[M+Na]+ 160.07328 134.2
[M-H]- 136.07678 130.7
[M+NH4]+ 155.11788 148.2
[M+K]+ 176.04722 133.5
[M+H-H2O]+ 120.08132 121.0
[M+HCOO]- 182.08226 151.7
[M+CH3COO]- 196.09791 177.1
[M+Na-2H]- 158.05873 133.7
[M]+ 137.08351 126.5
[M]- 137.08461 126.5
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