CID 71122589

1822518-66-0

Structural Information

Molecular Formula
C9H14N2O4
SMILES
CC(C)(C)OC(=O)NC1CC(=O)NC1=O
InChI
InChI=1S/C9H14N2O4/c1-9(2,3)15-8(14)10-5-4-6(12)11-7(5)13/h5H,4H2,1-3H3,(H,10,14)(H,11,12,13)
InChIKey
ADNLCKRUARJETQ-UHFFFAOYSA-N
Compound name
tert-butyl N-(2,5-dioxopyrrolidin-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

214.09535 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.102626 146.5
[M+Na]+ 237.084568 153.1
[M-H]- 213.088074 147.5
[M+NH4]+ 232.129173 164.8
[M+K]+ 253.058508 152.1
[M+H-H2O]+ 197.092610 141.1
[M+HCOO]- 259.093551 165.9
[M+CH3COO]- 273.109201 184.3
[M+Na-2H]- 235.070016 148.9
[M]+ 214.09480142 145.1
[M]- 214.09589858 145.1
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