CID 9607499

329779-09-1

Structural Information

Molecular Formula
C17H19N3O2
SMILES
CC1=C(C=CO1)C(=O)N/N=C/C=C/C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C17H19N3O2/c1-13-16(10-12-22-13)17(21)19-18-11-4-5-14-6-8-15(9-7-14)20(2)3/h4-12H,1-3H3,(H,19,21)/b5-4+,18-11+
InChIKey
FBUNRXOKEMUEOJ-MFVXBXEFSA-N
Compound name
N-[(E)-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enylidene]amino]-2-methylfuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

297.14774 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.15502 173.4
[M+Na]+ 320.13696 179.1
[M-H]- 296.14046 183.6
[M+NH4]+ 315.18156 189.5
[M+K]+ 336.11090 177.6
[M+H-H2O]+ 280.14500 164.8
[M+HCOO]- 342.14594 201.7
[M+CH3COO]- 356.16159 214.7
[M+Na-2H]- 318.12241 176.4
[M]+ 297.14719 176.5
[M]- 297.14829 176.5
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.