CID 131165986

1934372-42-5

Structural Information

Molecular Formula
C11H17N3O4
SMILES
CC(C)(C)OC(=O)N1CCN2C(C1)C(=O)NC2=O
InChI
InChI=1S/C11H17N3O4/c1-11(2,3)18-10(17)13-4-5-14-7(6-13)8(15)12-9(14)16/h7H,4-6H2,1-3H3,(H,12,15,16)
InChIKey
DBLHOCRPOWKYJA-UHFFFAOYSA-N
Compound name
tert-butyl 1,3-dioxo-5,6,8,8a-tetrahydroimidazo[1,5-a]pyrazine-7-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

255.1219 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.12918 158.2
[M+Na]+ 278.11112 165.4
[M+NH4]+ 273.15572 162.5
[M+K]+ 294.08506 165.1
[M-H]- 254.11462 154.5
[M+Na-2H]- 276.09657 157.3
[M]+ 255.12135 157.5
[M]- 255.12245 157.5
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