CID 145866938

2344685-96-5

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CC(C)(C)OC(=O)N1CC(C2C1C2)CN
InChI
InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-6-7(5-12)8-4-9(8)13/h7-9H,4-6,12H2,1-3H3
InChIKey
ZBBBKIXTLQEGAK-UHFFFAOYSA-N
Compound name
tert-butyl 4-(aminomethyl)-2-azabicyclo[3.1.0]hexane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.15248 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.159756 152.4
[M+Na]+ 235.141698 161.4
[M-H]- 211.145204 155.9
[M+NH4]+ 230.186303 168.0
[M+K]+ 251.115638 158.0
[M+H-H2O]+ 195.149740 147.1
[M+HCOO]- 257.150681 171.0
[M+CH3COO]- 271.166331 192.6
[M+Na-2H]- 233.127146 154.9
[M]+ 212.15193142 155.2
[M]- 212.15302858 155.2
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

No patent data available for this compound.