CID 17170920

[2-(3-fluorophenoxy)ethyl](methyl)amine hydrochloride

Structural Information

Molecular Formula
C9H12FNO
SMILES
CNCCOC1=CC(=CC=C1)F
InChI
InChI=1S/C9H12FNO/c1-11-5-6-12-9-4-2-3-8(10)7-9/h2-4,7,11H,5-6H2,1H3
InChIKey
WFOXAIJLPLVEMI-UHFFFAOYSA-N
Compound name
2-(3-fluorophenoxy)-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

169.09029 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.097566 133.3
[M+Na]+ 192.079508 140.8
[M-H]- 168.083014 135.7
[M+NH4]+ 187.124113 153.7
[M+K]+ 208.053448 138.9
[M+H-H2O]+ 152.087550 126.4
[M+HCOO]- 214.088491 158.1
[M+CH3COO]- 228.104141 182.0
[M+Na-2H]- 190.064956 140.6
[M]+ 169.08974142 133.1
[M]- 169.09083858 133.1
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