CID 82417357

5h,7h,8h-pyrano[4,3-d]pyrimidin-4-amine

Structural Information

Molecular Formula
C7H9N3O
SMILES
C1COCC2=C1N=CN=C2N
InChI
InChI=1S/C7H9N3O/c8-7-5-3-11-2-1-6(5)9-4-10-7/h4H,1-3H2,(H2,8,9,10)
InChIKey
XRKGQDIIBVFKPO-UHFFFAOYSA-N
Compound name
7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

151.07455 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08183 129.2
[M+Na]+ 174.06377 142.0
[M+NH4]+ 169.10837 138.0
[M+K]+ 190.03771 136.4
[M-H]- 150.06727 132.7
[M+Na-2H]- 172.04922 135.3
[M]+ 151.07400 131.9
[M]- 151.07510 131.9
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