CID 138039515

2241138-43-0

Structural Information

Molecular Formula
C8H15N3O
SMILES
CN1CCN2C(C1)CC(C2=O)N
InChI
InChI=1S/C8H15N3O/c1-10-2-3-11-6(5-10)4-7(9)8(11)12/h6-7H,2-5,9H2,1H3
InChIKey
KPWBRZSYCLWNRI-UHFFFAOYSA-N
Compound name
7-amino-2-methyl-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.1215 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.12878 137.8
[M+Na]+ 192.11072 145.1
[M-H]- 168.11422 138.8
[M+NH4]+ 187.15532 158.2
[M+K]+ 208.08466 142.9
[M+H-H2O]+ 152.11876 131.1
[M+HCOO]- 214.11970 155.7
[M+CH3COO]- 228.13535 181.3
[M+Na-2H]- 190.09617 140.3
[M]+ 169.12095 132.3
[M]- 169.12205 132.3
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.