CID 90168820

1610704-18-1

Structural Information

Molecular Formula
C10H20N2O2
SMILES
C[C@@H]1[C@H](CCN1C(=O)OC(C)(C)C)N
InChI
InChI=1S/C10H20N2O2/c1-7-8(11)5-6-12(7)9(13)14-10(2,3)4/h7-8H,5-6,11H2,1-4H3/t7-,8+/m1/s1
InChIKey
WKBDQHQZEPPWBJ-SFYZADRCSA-N
Compound name
tert-butyl (2R,3S)-3-amino-2-methylpyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

200.15248 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.15976 148.2
[M+Na]+ 223.14170 154.6
[M-H]- 199.14520 150.0
[M+NH4]+ 218.18630 167.9
[M+K]+ 239.11564 154.0
[M+H-H2O]+ 183.14974 142.6
[M+HCOO]- 245.15068 167.4
[M+CH3COO]- 259.16633 186.7
[M+Na-2H]- 221.12715 149.2
[M]+ 200.15193 146.6
[M]- 200.15303 146.6
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