CID 5074016

51513-80-5

Structural Information

Molecular Formula
C15H24N2O6
SMILES
CC(C)(C)OC(=O)NCCCCCC(=O)ON1C(=O)CCC1=O
InChI
InChI=1S/C15H24N2O6/c1-15(2,3)22-14(21)16-10-6-4-5-7-13(20)23-17-11(18)8-9-12(17)19/h4-10H2,1-3H3,(H,16,21)
InChIKey
TYJPSIQEEXOQLC-UHFFFAOYSA-N
Compound name
(2,5-dioxopyrrolidin-1-yl) 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

234
Patents

328.16342 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.17070 176.3
[M+Na]+ 351.15264 180.5
[M+NH4]+ 346.19724 178.5
[M+K]+ 367.12658 180.8
[M-H]- 327.15614 172.3
[M+Na-2H]- 349.13809 174.8
[M]+ 328.16287 174.9
[M]- 328.16397 174.9
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