CID 155895082

Tert-butyl n-{2-azabicyclo[2.2.1]heptan-4-yl}carbamate

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CC(C)(C)OC(=O)NC12CCC(C1)NC2
InChI
InChI=1S/C11H20N2O2/c1-10(2,3)15-9(14)13-11-5-4-8(6-11)12-7-11/h8,12H,4-7H2,1-3H3,(H,13,14)
InChIKey
RDDICJUIVVNNIP-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-azabicyclo[2.2.1]heptan-4-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

212.15248 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.159756 152.5
[M+Na]+ 235.141698 157.7
[M-H]- 211.145204 152.3
[M+NH4]+ 230.186303 176.0
[M+K]+ 251.115638 156.1
[M+H-H2O]+ 195.149740 148.3
[M+HCOO]- 257.150681 169.4
[M+CH3COO]- 271.166331 184.3
[M+Na-2H]- 233.127146 157.0
[M]+ 212.15193142 150.1
[M]- 212.15302858 150.1
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