CID 15954175

6-decyl-2-tetrahydrofuran-2-yloxy-furo[2,3-d]pyrimidine

Structural Information

Molecular Formula
C20H30N2O3
SMILES
CCCCCCCCCCC1=CC2=CN=C(N=C2O1)OC3CCCO3
InChI
InChI=1S/C20H30N2O3/c1-2-3-4-5-6-7-8-9-11-17-14-16-15-21-20(22-19(16)24-17)25-18-12-10-13-23-18/h14-15,18H,2-13H2,1H3
InChIKey
OCUMBPSCFAMSSD-UHFFFAOYSA-N
Compound name
6-decyl-2-(oxolan-2-yloxy)furo[2,3-d]pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

346.22565 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.23293 185.4
[M+Na]+ 369.21487 191.2
[M-H]- 345.21837 190.6
[M+NH4]+ 364.25947 197.8
[M+K]+ 385.18881 189.3
[M+H-H2O]+ 329.22291 176.8
[M+HCOO]- 391.22385 203.7
[M+CH3COO]- 405.23950 211.6
[M+Na-2H]- 367.20032 186.2
[M]+ 346.22510 192.6
[M]- 346.22620 192.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.