CID 43236669

5-bromo-3-methyl-1-benzofuran-2-carboxamide

Structural Information

Molecular Formula
C10H8BrNO2
SMILES
CC1=C(OC2=C1C=C(C=C2)Br)C(=O)N
InChI
InChI=1S/C10H8BrNO2/c1-5-7-4-6(11)2-3-8(7)14-9(5)10(12)13/h2-4H,1H3,(H2,12,13)
InChIKey
GYTSTTJYQZEMFW-UHFFFAOYSA-N
Compound name
5-bromo-3-methyl-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

252.97385 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.98113 148.0
[M+Na]+ 275.96307 161.9
[M-H]- 251.96657 156.4
[M+NH4]+ 271.00767 170.2
[M+K]+ 291.93701 151.6
[M+H-H2O]+ 235.97111 148.2
[M+HCOO]- 297.97205 170.6
[M+CH3COO]- 311.98770 193.0
[M+Na-2H]- 273.94852 154.7
[M]+ 252.97330 169.1
[M]- 252.97440 169.1
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