CID 165665092

2792186-54-8

Structural Information

Molecular Formula
C10H18F2N2O2
SMILES
CC(C)(C)OC(=O)N1CCC(C1)(C(F)F)N
InChI
InChI=1S/C10H18F2N2O2/c1-9(2,3)16-8(15)14-5-4-10(13,6-14)7(11)12/h7H,4-6,13H2,1-3H3
InChIKey
OVMVTDOSRCWJFQ-UHFFFAOYSA-N
Compound name
tert-butyl 3-amino-3-(difluoromethyl)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.13364 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.140916 151.8
[M+Na]+ 259.122858 158.0
[M-H]- 235.126364 150.8
[M+NH4]+ 254.167463 171.6
[M+K]+ 275.096798 157.3
[M+H-H2O]+ 219.130900 145.3
[M+HCOO]- 281.131841 168.0
[M+CH3COO]- 295.147491 191.3
[M+Na-2H]- 257.108306 152.6
[M]+ 236.13309142 147.1
[M]- 236.13418858 147.1
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

No patent data available for this compound.