CID 83855147

6,7,7-trimethyl-1h,2h,3h,4h,5h,6h,7h-pyrrolo[3,4-d]pyrimidine-2,4-dione

Structural Information

Molecular Formula
C9H13N3O2
SMILES
CC1(C2=C(CN1C)C(=O)NC(=O)N2)C
InChI
InChI=1S/C9H13N3O2/c1-9(2)6-5(4-12(9)3)7(13)11-8(14)10-6/h4H2,1-3H3,(H2,10,11,13,14)
InChIKey
BQAACFDVIUKGAH-UHFFFAOYSA-N
Compound name
6,7,7-trimethyl-1,5-dihydropyrrolo[3,4-d]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.10077 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.10805 141.8
[M+Na]+ 218.08999 153.8
[M+NH4]+ 213.13459 149.5
[M+K]+ 234.06393 148.9
[M-H]- 194.09349 140.3
[M+Na-2H]- 216.07544 146.0
[M]+ 195.10022 142.9
[M]- 195.10132 142.9
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.

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No patent data available for this compound.