CID 6482465

5-[2-(6-methoxy-2-naphthyl)propyl]furo[2,3-d]pyrimidine-2,4-diamine

Structural Information

Molecular Formula
C20H20N4O2
SMILES
CC(CC1=COC2=NC(=NC(=C12)N)N)C3=CC4=C(C=C3)C=C(C=C4)OC
InChI
InChI=1S/C20H20N4O2/c1-11(7-15-10-26-19-17(15)18(21)23-20(22)24-19)12-3-4-14-9-16(25-2)6-5-13(14)8-12/h3-6,8-11H,7H2,1-2H3,(H4,21,22,23,24)
InChIKey
SARGYMIXEVYXIC-UHFFFAOYSA-N
Compound name
5-[2-(6-methoxynaphthalen-2-yl)propyl]furo[2,3-d]pyrimidine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

348.15863 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.16591 184.5
[M+Na]+ 371.14785 194.5
[M-H]- 347.15135 191.5
[M+NH4]+ 366.19245 196.8
[M+K]+ 387.12179 189.7
[M+H-H2O]+ 331.15589 175.0
[M+HCOO]- 393.15683 205.0
[M+CH3COO]- 407.17248 195.3
[M+Na-2H]- 369.13330 188.4
[M]+ 348.15808 188.0
[M]- 348.15918 188.1
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.