CID 475760

5-(3,4,5-trimethoxyphenyl)-5,6-dihydrofuro[2,3-d]pyrimidine-2,4-diamine

Structural Information

Molecular Formula
C15H18N4O4
SMILES
COC1=CC(=CC(=C1OC)OC)C2COC3=NC(=NC(=C23)N)N
InChI
InChI=1S/C15H18N4O4/c1-20-9-4-7(5-10(21-2)12(9)22-3)8-6-23-14-11(8)13(16)18-15(17)19-14/h4-5,8H,6H2,1-3H3,(H4,16,17,18,19)
InChIKey
OVPJNOAPWGKISK-UHFFFAOYSA-N
Compound name
5-(3,4,5-trimethoxyphenyl)-5,6-dihydrofuro[2,3-d]pyrimidine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

318.1328 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.14008 173.7
[M+Na]+ 341.12202 183.4
[M-H]- 317.12552 179.8
[M+NH4]+ 336.16662 186.5
[M+K]+ 357.09596 181.3
[M+H-H2O]+ 301.13006 164.9
[M+HCOO]- 363.13100 194.7
[M+CH3COO]- 377.14665 213.3
[M+Na-2H]- 339.10747 176.1
[M]+ 318.13225 177.7
[M]- 318.13335 177.7
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.