CID 10820597

14757-80-3

Structural Information

Molecular Formula
C7H9NO2
SMILES
CN(C)C(=O)C1=COC=C1
InChI
InChI=1S/C7H9NO2/c1-8(2)7(9)6-3-4-10-5-6/h3-5H,1-2H3
InChIKey
GLKZDYDVSBCMAA-UHFFFAOYSA-N
Compound name
N,N-dimethylfuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

48
Patents

139.06332 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.07060 127.4
[M+Na]+ 162.05254 134.9
[M-H]- 138.05604 133.4
[M+NH4]+ 157.09714 149.8
[M+K]+ 178.02648 136.9
[M+H-H2O]+ 122.06058 121.9
[M+HCOO]- 184.06152 153.6
[M+CH3COO]- 198.07717 177.0
[M+Na-2H]- 160.03799 133.6
[M]+ 139.06277 129.8
[M]- 139.06387 129.8
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

patents stripe