CID 25324815

1050890-47-5

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CC(C)(C)OC(=O)NC12CCC(C1)(C2)N
InChI
InChI=1S/C11H20N2O2/c1-9(2,3)15-8(14)13-11-5-4-10(12,6-11)7-11/h4-7,12H2,1-3H3,(H,13,14)
InChIKey
BNNXJCJQIVVPTF-UHFFFAOYSA-N
Compound name
tert-butyl N-(4-amino-1-bicyclo[2.1.1]hexanyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

212.15248 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.15976 163.7
[M+Na]+ 235.14170 167.6
[M-H]- 211.14520 164.0
[M+NH4]+ 230.18630 185.7
[M+K]+ 251.11564 168.9
[M+H-H2O]+ 195.14974 157.3
[M+HCOO]- 257.15068 180.0
[M+CH3COO]- 271.16633 194.4
[M+Na-2H]- 233.12715 170.8
[M]+ 212.15193 174.9
[M]- 212.15303 174.9
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