CID 66982058

1352745-78-8

Structural Information

Molecular Formula
C15H25NO5
SMILES
CC1(CCC(=O)N1C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
InChI
InChI=1S/C15H25NO5/c1-13(2,3)20-11(18)15(7)9-8-10(17)16(15)12(19)21-14(4,5)6/h8-9H2,1-7H3
InChIKey
ORKNGPXCDFIMEM-UHFFFAOYSA-N
Compound name
ditert-butyl 2-methyl-5-oxopyrrolidine-1,2-dicarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

299.17328 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.18056 166.6
[M+Na]+ 322.16250 173.3
[M-H]- 298.16600 168.9
[M+NH4]+ 317.20710 184.9
[M+K]+ 338.13644 173.8
[M+H-H2O]+ 282.17054 163.1
[M+HCOO]- 344.17148 182.4
[M+CH3COO]- 358.18713 201.4
[M+Na-2H]- 320.14795 168.6
[M]+ 299.17273 170.9
[M]- 299.17383 170.9
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