CID 22281318

356044-81-0

Structural Information

Molecular Formula
C7H15FN2
SMILES
C1CNCCN(C1)CCF
InChI
InChI=1S/C7H15FN2/c8-2-6-10-5-1-3-9-4-7-10/h9H,1-7H2
InChIKey
QZPJUPNIVVBDBF-UHFFFAOYSA-N
Compound name
1-(2-fluoroethyl)-1,4-diazepane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

146.12193 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.12921 127.0
[M+Na]+ 169.11115 134.7
[M+NH4]+ 164.15575 133.7
[M+K]+ 185.08509 130.8
[M-H]- 145.11465 126.0
[M+Na-2H]- 167.09660 131.5
[M]+ 146.12138 127.5
[M]- 146.12248 127.5
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