CID 103438865

3-(cyclopropylamino)phenol

Structural Information

Molecular Formula
C9H11NO
SMILES
C1CC1NC2=CC(=CC=C2)O
InChI
InChI=1S/C9H11NO/c11-9-3-1-2-8(6-9)10-7-4-5-7/h1-3,6-7,10-11H,4-5H2
InChIKey
CLLMMWLNILSNMO-UHFFFAOYSA-N
Compound name
3-(cyclopropylamino)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.08406 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.09134 126.0
[M+Na]+ 172.07328 135.1
[M-H]- 148.07678 132.7
[M+NH4]+ 167.11788 141.7
[M+K]+ 188.04722 131.8
[M+H-H2O]+ 132.08132 120.0
[M+HCOO]- 194.08226 151.0
[M+CH3COO]- 208.09791 178.7
[M+Na-2H]- 170.05873 134.2
[M]+ 149.08351 126.5
[M]- 149.08461 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.