CID 84726054

Tert-butyl n-(1-amino-2-cyclobutylpropan-2-yl)carbamate

Structural Information

Molecular Formula
C12H24N2O2
SMILES
CC(C)(C)OC(=O)NC(C)(CN)C1CCC1
InChI
InChI=1S/C12H24N2O2/c1-11(2,3)16-10(15)14-12(4,8-13)9-6-5-7-9/h9H,5-8,13H2,1-4H3,(H,14,15)
InChIKey
NBIBQBHUPJWLDC-UHFFFAOYSA-N
Compound name
tert-butyl N-(1-amino-2-cyclobutylpropan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.18378 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.19106 160.2
[M+Na]+ 251.17300 161.9
[M-H]- 227.17650 162.4
[M+NH4]+ 246.21760 170.9
[M+K]+ 267.14694 164.8
[M+H-H2O]+ 211.18104 148.7
[M+HCOO]- 273.18198 177.9
[M+CH3COO]- 287.19763 198.0
[M+Na-2H]- 249.15845 162.9
[M]+ 228.18323 166.8
[M]- 228.18433 166.8
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.