CID 131491964

2580211-03-4

Structural Information

Molecular Formula
C6H9N3O2
SMILES
C1C(COC2=C(C=NN21)N)O
InChI
InChI=1S/C6H9N3O2/c7-5-1-8-9-2-4(10)3-11-6(5)9/h1,4,10H,2-3,7H2
InChIKey
CBNBKUFZOLRKHU-UHFFFAOYSA-N
Compound name
3-amino-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.06947 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.07675 129.2
[M+Na]+ 178.05869 137.8
[M-H]- 154.06219 130.1
[M+NH4]+ 173.10329 148.1
[M+K]+ 194.03263 136.8
[M+H-H2O]+ 138.06673 122.7
[M+HCOO]- 200.06767 148.3
[M+CH3COO]- 214.08332 142.2
[M+Na-2H]- 176.04414 135.8
[M]+ 155.06892 126.5
[M]- 155.07002 126.5
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

No patent data available for this compound.