CID 117274578

{5h,6h,7h,8h-pyrido[2,3-d]pyrimidin-2-yl}methanol hydrochloride

Structural Information

Molecular Formula
C8H11N3O
SMILES
C1CC2=CN=C(N=C2NC1)CO
InChI
InChI=1S/C8H11N3O/c12-5-7-10-4-6-2-1-3-9-8(6)11-7/h4,12H,1-3,5H2,(H,9,10,11)
InChIKey
MDUJLMIAWIFAEJ-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-2-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.09021 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.09749 135.5
[M+Na]+ 188.07943 142.9
[M-H]- 164.08293 132.8
[M+NH4]+ 183.12403 151.6
[M+K]+ 204.05337 139.0
[M+H-H2O]+ 148.08747 127.8
[M+HCOO]- 210.08841 150.6
[M+CH3COO]- 224.10406 146.5
[M+Na-2H]- 186.06488 143.8
[M]+ 165.08966 130.7
[M]- 165.09076 130.7
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.