CID 3008197

1-(benzyloxymethyl)-7-phenyl-5,7-dihydrofuro[3,4-d]pyrimidine-2,4-dione

Structural Information

Molecular Formula
C20H18N2O4
SMILES
C1C2=C(C(O1)C3=CC=CC=C3)N(C(=O)NC2=O)COCC4=CC=CC=C4
InChI
InChI=1S/C20H18N2O4/c23-19-16-12-26-18(15-9-5-2-6-10-15)17(16)22(20(24)21-19)13-25-11-14-7-3-1-4-8-14/h1-10,18H,11-13H2,(H,21,23,24)
InChIKey
WZZXDAPUHLEFKC-UHFFFAOYSA-N
Compound name
7-phenyl-1-(phenylmethoxymethyl)-5,7-dihydrofuro[3,4-d]pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

350.12665 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.133926 180.4
[M+Na]+ 373.115868 189.3
[M-H]- 349.119374 188.3
[M+NH4]+ 368.160473 191.0
[M+K]+ 389.089808 184.2
[M+H-H2O]+ 333.123910 170.3
[M+HCOO]- 395.124851 199.0
[M+CH3COO]- 409.140501 191.0
[M+Na-2H]- 371.101316 183.9
[M]+ 350.12610142 182.5
[M]- 350.12719858 182.5
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.