CID 136209770

1247517-44-7

Structural Information

Molecular Formula
C10H12N2O
SMILES
C1CC2=C(C1)N=C(NC2=O)C3CC3
InChI
InChI=1S/C10H12N2O/c13-10-7-2-1-3-8(7)11-9(12-10)6-4-5-6/h6H,1-5H2,(H,11,12,13)
InChIKey
HRFUMFZRYZHYEJ-UHFFFAOYSA-N
Compound name
2-cyclopropyl-3,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.09496 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 141.3
[M+Na]+ 199.08418 152.3
[M-H]- 175.08768 145.8
[M+NH4]+ 194.12878 156.3
[M+K]+ 215.05812 146.9
[M+H-H2O]+ 159.09222 134.1
[M+HCOO]- 221.09316 161.3
[M+CH3COO]- 235.10881 153.8
[M+Na-2H]- 197.06963 146.3
[M]+ 176.09441 141.3
[M]- 176.09551 141.3
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

No patent data available for this compound.