CID 5747165

Brn 5263041

Structural Information

Molecular Formula
C8H10N4O
SMILES
C1=CNC2=C1N=CN=C2NCCO
InChI
InChI=1S/C8H10N4O/c13-4-3-10-8-7-6(1-2-9-7)11-5-12-8/h1-2,5,9,13H,3-4H2,(H,10,11,12)
InChIKey
VRTYNHUAGLAXJE-UHFFFAOYSA-N
Compound name
2-(5H-pyrrolo[3,2-d]pyrimidin-4-ylamino)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.08546 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.09274 134.5
[M+Na]+ 201.07468 144.0
[M-H]- 177.07818 133.0
[M+NH4]+ 196.11928 152.0
[M+K]+ 217.04862 139.8
[M+H-H2O]+ 161.08272 126.9
[M+HCOO]- 223.08366 155.9
[M+CH3COO]- 237.09931 146.9
[M+Na-2H]- 199.06013 143.8
[M]+ 178.08491 134.1
[M]- 178.08601 134.1
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.