CID 30697

Ethanone, 1-(5-methoxy-2-benzofuranyl)-

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
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 136.2
[M+Na]+ 213.05221 147.1
[M-H]- 189.05571 142.6
[M+NH4]+ 208.09681 158.0
[M+K]+ 229.02615 146.3
[M+H-H2O]+ 173.06025 131.3
[M+HCOO]- 235.06119 161.2
[M+CH3COO]- 249.07684 182.8
[M+Na-2H]- 211.03766 143.4
[M]+ 190.06244 142.3
[M]- 190.06354 142.3
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