CID 45692

2-furamide, 5-tert-butyl-

Structural Information

Molecular Formula
C9H13NO2
SMILES
CC(C)(C)C1=CC=C(O1)C(=O)N
InChI
InChI=1S/C9H13NO2/c1-9(2,3)7-5-4-6(12-7)8(10)11/h4-5H,1-3H3,(H2,10,11)
InChIKey
NFABBAWHYBOFPI-UHFFFAOYSA-N
Compound name
5-tert-butylfuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

167.09464 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.101916 136.0
[M+Na]+ 190.083858 143.9
[M-H]- 166.087364 140.3
[M+NH4]+ 185.128463 156.8
[M+K]+ 206.057798 144.0
[M+H-H2O]+ 150.091900 131.3
[M+HCOO]- 212.092841 158.8
[M+CH3COO]- 226.108491 180.3
[M+Na-2H]- 188.069306 141.1
[M]+ 167.09409142 136.8
[M]- 167.09518858 136.8
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