CID 68158009

Tert-butyl n-(3-cyanocyclobutyl)carbamate

Structural Information

Molecular Formula
C10H16N2O2
SMILES
CC(C)(C)OC(=O)NC1CC(C1)C#N
InChI
InChI=1S/C10H16N2O2/c1-10(2,3)14-9(13)12-8-4-7(5-8)6-11/h7-8H,4-5H2,1-3H3,(H,12,13)
InChIKey
QCUKEYZJVYABFL-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-cyanocyclobutyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

196.12119 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.12847 150.7
[M+Na]+ 219.11041 154.7
[M+NH4]+ 214.15501 150.6
[M+K]+ 235.08435 149.4
[M-H]- 195.11391 141.4
[M+Na-2H]- 217.09586 149.0
[M]+ 196.12064 146.6
[M]- 196.12174 146.6
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