CID 22289852

2-{[(4-methoxyphenyl)methyl]amino}propan-1-ol

Structural Information

Molecular Formula
C11H17NO2
SMILES
CC(CO)NCC1=CC=C(C=C1)OC
InChI
InChI=1S/C11H17NO2/c1-9(8-13)12-7-10-3-5-11(14-2)6-4-10/h3-6,9,12-13H,7-8H2,1-2H3
InChIKey
JECRNIMUUGOGMJ-UHFFFAOYSA-N
Compound name
2-[(4-methoxyphenyl)methylamino]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

195.12593 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.13321 144.2
[M+Na]+ 218.11515 155.0
[M+NH4]+ 213.15975 152.0
[M+K]+ 234.08909 149.2
[M-H]- 194.11865 146.1
[M+Na-2H]- 216.10060 150.0
[M]+ 195.12538 146.1
[M]- 195.12648 146.1
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

patents stripe