CID 3081137

4-hydroxy-3-methoxymethamphetamine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

38
References

209
Patents

195.12593 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.133206 143.9
[M+Na]+ 218.115148 150.7
[M-H]- 194.118654 146.4
[M+NH4]+ 213.159753 162.8
[M+K]+ 234.089088 148.9
[M+H-H2O]+ 178.123190 138.0
[M+HCOO]- 240.124131 166.8
[M+CH3COO]- 254.139781 186.8
[M+Na-2H]- 216.100596 148.1
[M]+ 195.12538142 144.9
[M]- 195.12647858 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.