CID 53488449

1523571-18-7

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CC(C)(C)OC(=O)N1CC2CC1CNC2
InChI
InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-7-8-4-9(13)6-12-5-8/h8-9,12H,4-7H2,1-3H3
InChIKey
CSQBUSQTOWHXLW-UHFFFAOYSA-N
Compound name
tert-butyl 3,6-diazabicyclo[3.2.1]octane-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

87
Patents

212.15248 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.159756 153.1
[M+Na]+ 235.141698 158.3
[M-H]- 211.145204 151.2
[M+NH4]+ 230.186303 172.1
[M+K]+ 251.115638 156.5
[M+H-H2O]+ 195.149740 147.3
[M+HCOO]- 257.150681 165.5
[M+CH3COO]- 271.166331 183.7
[M+Na-2H]- 233.127146 156.3
[M]+ 212.15193142 149.9
[M]- 212.15302858 149.9
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