CID 2756442

4-amino-n-(2-furylmethyl)benzamide

Structural Information

Molecular Formula
C12H12N2O2
SMILES
C1=COC(=C1)CNC(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C12H12N2O2/c13-10-5-3-9(4-6-10)12(15)14-8-11-2-1-7-16-11/h1-7H,8,13H2,(H,14,15)
InChIKey
AABBIAOWKMFHJI-UHFFFAOYSA-N
Compound name
4-amino-N-(furan-2-ylmethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

216.08987 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.09715 147.1
[M+Na]+ 239.07909 153.7
[M-H]- 215.08259 154.3
[M+NH4]+ 234.12369 164.9
[M+K]+ 255.05303 151.9
[M+H-H2O]+ 199.08713 139.9
[M+HCOO]- 261.08807 173.0
[M+CH3COO]- 275.10372 189.7
[M+Na-2H]- 237.06454 152.4
[M]+ 216.08932 146.2
[M]- 216.09042 146.2
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