CID 58748331

913744-63-5

Structural Information

Molecular Formula
C14H23NO4
SMILES
CC(C)(C)OC(=O)N1C[C@@H]([C@H](C1)C(=O)OC)C2CC2
InChI
InChI=1S/C14H23NO4/c1-14(2,3)19-13(17)15-7-10(9-5-6-9)11(8-15)12(16)18-4/h9-11H,5-8H2,1-4H3/t10-,11+/m1/s1
InChIKey
UJFBKQAYFROGQA-MNOVXSKESA-N
Compound name
1-O-tert-butyl 3-O-methyl (3R,4R)-4-cyclopropylpyrrolidine-1,3-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

269.16272 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.17000 164.7
[M+Na]+ 292.15194 172.1
[M-H]- 268.15544 170.6
[M+NH4]+ 287.19654 177.2
[M+K]+ 308.12588 169.9
[M+H-H2O]+ 252.15998 158.8
[M+HCOO]- 314.16092 182.1
[M+CH3COO]- 328.17657 199.0
[M+Na-2H]- 290.13739 164.0
[M]+ 269.16217 169.1
[M]- 269.16327 169.1
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