CID 39378

2-acetyl-7-methoxybenzofuran

Structural Information

Molecular Formula
C11H10O3
SMILES
CC(=O)C1=CC2=C(O1)C(=CC=C2)OC
InChI
InChI=1S/C11H10O3/c1-7(12)10-6-8-4-3-5-9(13-2)11(8)14-10/h3-6H,1-2H3
InChIKey
MUUMFANQVPWPFY-UHFFFAOYSA-N
Compound name
1-(7-methoxy-1-benzofuran-2-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

144
Patents

190.06299 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.07027 136.4
[M+Na]+ 213.05221 150.3
[M+NH4]+ 208.09681 145.2
[M+K]+ 229.02615 146.3
[M-H]- 189.05571 139.7
[M+Na-2H]- 211.03766 142.5
[M]+ 190.06244 139.3
[M]- 190.06354 139.3
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