CID 16078823

4-[(cyclopropylamino)methyl]-2-methoxyphenol hydrochloride

Structural Information

Molecular Formula
C11H15NO2
SMILES
COC1=C(C=CC(=C1)CNC2CC2)O
InChI
InChI=1S/C11H15NO2/c1-14-11-6-8(2-5-10(11)13)7-12-9-3-4-9/h2,5-6,9,12-13H,3-4,7H2,1H3
InChIKey
UTUZHFORZIYQQF-UHFFFAOYSA-N
Compound name
4-[(cyclopropylamino)methyl]-2-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

193.11028 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.11756 138.2
[M+Na]+ 216.09950 147.2
[M-H]- 192.10300 144.8
[M+NH4]+ 211.14410 152.4
[M+K]+ 232.07344 143.7
[M+H-H2O]+ 176.10754 131.8
[M+HCOO]- 238.10848 162.6
[M+CH3COO]- 252.12413 187.6
[M+Na-2H]- 214.08495 144.6
[M]+ 193.10973 141.1
[M]- 193.11083 141.1
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

No patent data available for this compound.