CID 19892757

Cyclopentyl(pyrimidin-2-yl)methanol

Structural Information

Molecular Formula
C10H14N2O
SMILES
C1CCC(C1)C(C2=NC=CC=N2)O
InChI
InChI=1S/C10H14N2O/c13-9(8-4-1-2-5-8)10-11-6-3-7-12-10/h3,6-9,13H,1-2,4-5H2
InChIKey
MFJHDKZTIXMIBJ-UHFFFAOYSA-N
Compound name
cyclopentyl(pyrimidin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

178.11061 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.11789 139.2
[M+Na]+ 201.09983 144.7
[M-H]- 177.10333 141.3
[M+NH4]+ 196.14443 157.1
[M+K]+ 217.07377 142.3
[M+H-H2O]+ 161.10787 131.2
[M+HCOO]- 223.10881 157.9
[M+CH3COO]- 237.12446 176.3
[M+Na-2H]- 199.08528 143.1
[M]+ 178.11006 134.7
[M]- 178.11116 134.7
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

patents stripe