CID 59455759

1052713-48-0

Structural Information

Molecular Formula
C10H19FN2O2
SMILES
CC(C)(C)OC(=O)N[C@H]1CNCC[C@@H]1F
InChI
InChI=1S/C10H19FN2O2/c1-10(2,3)15-9(14)13-8-6-12-5-4-7(8)11/h7-8,12H,4-6H2,1-3H3,(H,13,14)/t7-,8-/m0/s1
InChIKey
PHKRFWRGEVHCAT-YUMQZZPRSA-N
Compound name
tert-butyl N-[(3S,4S)-4-fluoropiperidin-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

218.14305 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.15033 150.8
[M+Na]+ 241.13227 157.5
[M+NH4]+ 236.17687 156.3
[M+K]+ 257.10621 154.0
[M-H]- 217.13577 148.7
[M+Na-2H]- 239.11772 152.6
[M]+ 218.14250 150.6
[M]- 218.14360 150.6
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