CID 179091

5-hydroxymethoxyphenamine

Structural Information

Molecular Formula
C11H17NO2
SMILES
CC(CC1=C(C=CC(=C1)O)OC)NC
InChI
InChI=1S/C11H17NO2/c1-8(12-2)6-9-7-10(13)4-5-11(9)14-3/h4-5,7-8,12-13H,6H2,1-3H3
InChIKey
MJHSFKIGFVIAFL-UHFFFAOYSA-N
Compound name
4-methoxy-3-[2-(methylamino)propyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

3
Patents

195.12593 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.13321 143.9
[M+Na]+ 218.11515 150.7
[M-H]- 194.11865 146.4
[M+NH4]+ 213.15975 162.8
[M+K]+ 234.08909 148.9
[M+H-H2O]+ 178.12319 138.0
[M+HCOO]- 240.12413 166.8
[M+CH3COO]- 254.13978 186.8
[M+Na-2H]- 216.10060 148.1
[M]+ 195.12538 144.9
[M]- 195.12648 144.9
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