CID 50986476

Tert-butyl n-{3-azabicyclo[3.2.0]heptan-6-yl}carbamate

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CC(C)(C)OC(=O)NC1CC2C1CNC2
InChI
InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-9-4-7-5-12-6-8(7)9/h7-9,12H,4-6H2,1-3H3,(H,13,14)
InChIKey
ZBCUZTCLSWQWPS-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-azabicyclo[3.2.0]heptan-6-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

212.15248 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.15976 151.9
[M+Na]+ 235.14170 155.2
[M-H]- 211.14520 153.0
[M+NH4]+ 230.18630 164.6
[M+K]+ 251.11564 156.7
[M+H-H2O]+ 195.14974 141.2
[M+HCOO]- 257.15068 167.7
[M+CH3COO]- 271.16633 189.5
[M+Na-2H]- 233.12715 154.4
[M]+ 212.15193 157.7
[M]- 212.15303 157.7
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