CID 2757240

Tert-butyl 4-(methylcarbamoyl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C12H22N2O3
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC
InChI
InChI=1S/C12H22N2O3/c1-12(2,3)17-11(16)14-7-5-9(6-8-14)10(15)13-4/h9H,5-8H2,1-4H3,(H,13,15)
InChIKey
WPKSHDLVXHJHKV-UHFFFAOYSA-N
Compound name
tert-butyl 4-(methylcarbamoyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

242.16304 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.17032 157.9
[M+Na]+ 265.15226 161.7
[M-H]- 241.15576 159.2
[M+NH4]+ 260.19686 173.8
[M+K]+ 281.12620 161.5
[M+H-H2O]+ 225.16030 151.4
[M+HCOO]- 287.16124 174.4
[M+CH3COO]- 301.17689 194.0
[M+Na-2H]- 263.13771 159.8
[M]+ 242.16249 155.7
[M]- 242.16359 155.7
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