CID 86708894

2137987-37-0

Structural Information

Molecular Formula
C14H24N2O4
SMILES
CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CNC[C@]2(C1)C(=O)OC
InChI
InChI=1S/C14H24N2O4/c1-13(2,3)20-12(18)16-10-5-9-7-15-8-14(9,6-10)11(17)19-4/h9-10,15H,5-8H2,1-4H3,(H,16,18)/t9-,10+,14-/m0/s1
InChIKey
FXWYACZKPVXLKB-RBZYPMLTSA-N
Compound name
methyl (3aR,5R,6aR)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3a-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

284.1736 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.18088 166.3
[M+Na]+ 307.16282 169.8
[M+NH4]+ 302.20742 172.5
[M+K]+ 323.13676 169.8
[M-H]- 283.16632 163.4
[M+Na-2H]- 305.14827 166.4
[M]+ 284.17305 165.4
[M]- 284.17415 165.4
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