CID 84729003

1784899-57-5

Structural Information

Molecular Formula
C11H20F2N2O2
SMILES
CC(C)(C)OC(=O)NC1(CCNCC1)C(F)F
InChI
InChI=1S/C11H20F2N2O2/c1-10(2,3)17-9(16)15-11(8(12)13)4-6-14-7-5-11/h8,14H,4-7H2,1-3H3,(H,15,16)
InChIKey
ZCDNMZMKVDWJSS-UHFFFAOYSA-N
Compound name
tert-butyl N-[4-(difluoromethyl)piperidin-4-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.14928 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.15656 157.5
[M+Na]+ 273.13850 161.1
[M-H]- 249.14200 154.7
[M+NH4]+ 268.18310 174.1
[M+K]+ 289.11244 159.8
[M+H-H2O]+ 233.14654 150.3
[M+HCOO]- 295.14748 170.3
[M+CH3COO]- 309.16313 191.6
[M+Na-2H]- 271.12395 160.0
[M]+ 250.14873 149.9
[M]- 250.14983 149.9
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.