CID 53338751

879399-07-2

Structural Information

Molecular Formula
C7H14N2O
SMILES
C1CN2C[C@@H](C[C@H]2CN1)O
InChI
InChI=1S/C7H14N2O/c10-7-3-6-4-8-1-2-9(6)5-7/h6-8,10H,1-5H2/t6-,7+/m0/s1
InChIKey
VLVMRQREBYGIBY-NKWVEPMBSA-N
Compound name
(7R,8aS)-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazin-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

83
Patents

142.11061 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.117886 131.8
[M+Na]+ 165.099828 137.4
[M-H]- 141.103334 129.9
[M+NH4]+ 160.144433 151.9
[M+K]+ 181.073768 134.8
[M+H-H2O]+ 125.107870 125.4
[M+HCOO]- 187.108811 146.4
[M+CH3COO]- 201.124461 143.0
[M+Na-2H]- 163.085276 135.8
[M]+ 142.11006142 123.9
[M]- 142.11115858 123.9
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