CID 464121

Schembl549279

Structural Information

Molecular Formula
C20H24N4O
SMILES
CC(C)N=C(C1=CC2=C(C=C1)OC3=C2C=C(C=C3)C(=NC(C)C)N)N
InChI
InChI=1S/C20H24N4O/c1-11(2)23-19(21)13-5-7-17-15(9-13)16-10-14(6-8-18(16)25-17)20(22)24-12(3)4/h5-12H,1-4H3,(H2,21,23)(H2,22,24)
InChIKey
KDQIODRNMNRWQT-UHFFFAOYSA-N
Compound name
2-N',8-N'-di(propan-2-yl)dibenzofuran-2,8-dicarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

137
Patents

336.195 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.20228 186.1
[M+Na]+ 359.18422 191.8
[M-H]- 335.18772 194.0
[M+NH4]+ 354.22882 202.0
[M+K]+ 375.15816 189.7
[M+H-H2O]+ 319.19226 178.0
[M+HCOO]- 381.19320 209.9
[M+CH3COO]- 395.20885 229.3
[M+Na-2H]- 357.16967 187.3
[M]+ 336.19445 187.6
[M]- 336.19555 187.6
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