CID 10798157

190792-75-7

Structural Information

Molecular Formula
C9H18N2O3
SMILES
CC(C)(C)OC(=O)N1C[C@@H]([C@@H](C1)O)N
InChI
InChI=1S/C9H18N2O3/c1-9(2,3)14-8(13)11-4-6(10)7(12)5-11/h6-7,12H,4-5,10H2,1-3H3/t6-,7+/m0/s1
InChIKey
MOZOQDNRVPHFOO-NKWVEPMBSA-N
Compound name
tert-butyl (3S,4R)-3-amino-4-hydroxypyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

426
Patents

202.13174 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.13902 147.0
[M+Na]+ 225.12096 153.3
[M-H]- 201.12446 147.5
[M+NH4]+ 220.16556 165.8
[M+K]+ 241.09490 152.6
[M+H-H2O]+ 185.12900 141.7
[M+HCOO]- 247.12994 165.2
[M+CH3COO]- 261.14559 183.3
[M+Na-2H]- 223.10641 148.2
[M]+ 202.13119 144.6
[M]- 202.13229 144.6
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