CID 18335022

Tert-butyl (1-methyl-2,6-dioxopiperidin-3-yl)carbamate

Structural Information

Molecular Formula
C11H18N2O4
SMILES
CC(C)(C)OC(=O)NC1CCC(=O)N(C1=O)C
InChI
InChI=1S/C11H18N2O4/c1-11(2,3)17-10(16)12-7-5-6-8(14)13(4)9(7)15/h7H,5-6H2,1-4H3,(H,12,16)
InChIKey
FOYROUKGPPBNAN-UHFFFAOYSA-N
Compound name
tert-butyl N-(1-methyl-2,6-dioxopiperidin-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

139
Patents

242.12666 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.133936 153.5
[M+Na]+ 265.115878 159.9
[M-H]- 241.119384 155.7
[M+NH4]+ 260.160483 169.9
[M+K]+ 281.089818 159.4
[M+H-H2O]+ 225.123920 147.5
[M+HCOO]- 287.124861 171.7
[M+CH3COO]- 301.140511 194.6
[M+Na-2H]- 263.101326 156.0
[M]+ 242.12611142 153.2
[M]- 242.12720858 153.2
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