CID 80559237

Tert-butyl n-[3-(ethylamino)cyclobutyl]carbamate

Structural Information

Molecular Formula
C11H22N2O2
SMILES
CCNC1CC(C1)NC(=O)OC(C)(C)C
InChI
InChI=1S/C11H22N2O2/c1-5-12-8-6-9(7-8)13-10(14)15-11(2,3)4/h8-9,12H,5-7H2,1-4H3,(H,13,14)
InChIKey
AZHKRGVFDRBPFB-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-(ethylamino)cyclobutyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

214.16812 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.175396 155.1
[M+Na]+ 237.157338 157.7
[M-H]- 213.160844 158.0
[M+NH4]+ 232.201943 166.8
[M+K]+ 253.131278 160.7
[M+H-H2O]+ 197.165380 143.4
[M+HCOO]- 259.166321 175.3
[M+CH3COO]- 273.181971 196.4
[M+Na-2H]- 235.142786 157.9
[M]+ 214.16757142 163.2
[M]- 214.16866858 163.2
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