CID 12132800

500556-90-1

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1[C@@H](C2)N
InChI
InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-7-4-5-9(13)8(12)6-7/h7-9H,4-6,12H2,1-3H3/t7-,8-,9+/m1/s1
InChIKey
JRZFZVWZIJNIEQ-HLTSFMKQSA-N
Compound name
tert-butyl (1S,2R,4R)-2-amino-7-azabicyclo[2.2.1]heptane-7-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

117
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 148.8
[M+Na]+ 235.14170 154.7
[M+NH4]+ 230.18630 156.0
[M+K]+ 251.11564 155.1
[M-H]- 211.14520 147.1
[M+Na-2H]- 233.12715 148.0
[M]+ 212.15193 148.6
[M]- 212.15303 148.6
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