CID 11149935

1,2-di-tert-butyl pyrrolidine-1,2-dicarboxylate

Structural Information

Molecular Formula
C14H25NO4
SMILES
CC(C)(C)OC(=O)C1CCCN1C(=O)OC(C)(C)C
InChI
InChI=1S/C14H25NO4/c1-13(2,3)18-11(16)10-8-7-9-15(10)12(17)19-14(4,5)6/h10H,7-9H2,1-6H3
InChIKey
UMCYLERMBHATJC-UHFFFAOYSA-N
Compound name
ditert-butyl pyrrolidine-1,2-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

271.17834 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.18562 165.1
[M+Na]+ 294.16756 170.2
[M-H]- 270.17106 166.9
[M+NH4]+ 289.21216 182.3
[M+K]+ 310.14150 170.6
[M+H-H2O]+ 254.17560 160.0
[M+HCOO]- 316.17654 180.8
[M+CH3COO]- 330.19219 196.4
[M+Na-2H]- 292.15301 165.9
[M]+ 271.17779 167.4
[M]- 271.17889 167.4
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