CID 105429543

5h,6h,8h-pyrano[3,4-d]pyrimidin-2-amine

Structural Information

Molecular Formula
C7H9N3O
SMILES
C1COCC2=NC(=NC=C21)N
InChI
InChI=1S/C7H9N3O/c8-7-9-3-5-1-2-11-4-6(5)10-7/h3H,1-2,4H2,(H2,8,9,10)
InChIKey
ZEIMTIQODDCXRC-UHFFFAOYSA-N
Compound name
6,8-dihydro-5H-pyrano[3,4-d]pyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
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 129.0
[M+Na]+ 174.06377 136.9
[M-H]- 150.06727 130.8
[M+NH4]+ 169.10837 146.6
[M+K]+ 190.03771 135.8
[M+H-H2O]+ 134.07181 121.4
[M+HCOO]- 196.07275 148.3
[M+CH3COO]- 210.08840 141.9
[M+Na-2H]- 172.04922 138.9
[M]+ 151.07400 125.9
[M]- 151.07510 125.9
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