CID 84731220

[(4-fluorooxan-4-yl)methyl](methyl)amine hydrochloride

Structural Information

Molecular Formula
C7H14FNO
SMILES
CNCC1(CCOCC1)F
InChI
InChI=1S/C7H14FNO/c1-9-6-7(8)2-4-10-5-3-7/h9H,2-6H2,1H3
InChIKey
DBWCTASCUSAGIY-UHFFFAOYSA-N
Compound name
1-(4-fluorooxan-4-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

147.10594 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.113216 129.9
[M+Na]+ 170.095158 135.1
[M-H]- 146.098664 132.2
[M+NH4]+ 165.139763 151.4
[M+K]+ 186.069098 135.7
[M+H-H2O]+ 130.103200 124.0
[M+HCOO]- 192.104141 150.0
[M+CH3COO]- 206.119791 175.4
[M+Na-2H]- 168.080606 138.0
[M]+ 147.10539142 125.2
[M]- 147.10648858 125.2
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