CID 215270

2-benzofurancarbonitrile, 4-methoxy-

Structural Information

Molecular Formula
C10H7NO2
SMILES
COC1=CC=CC2=C1C=C(O2)C#N
InChI
InChI=1S/C10H7NO2/c1-12-9-3-2-4-10-8(9)5-7(6-11)13-10/h2-5H,1H3
InChIKey
BIHPNWHPANRXIG-UHFFFAOYSA-N
Compound name
4-methoxy-1-benzofuran-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

173.04768 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.05496 134.3
[M+Na]+ 196.03690 147.9
[M-H]- 172.04040 139.4
[M+NH4]+ 191.08150 154.5
[M+K]+ 212.01084 144.4
[M+H-H2O]+ 156.04494 122.4
[M+HCOO]- 218.04588 156.3
[M+CH3COO]- 232.06153 191.4
[M+Na-2H]- 194.02235 142.3
[M]+ 173.04713 134.1
[M]- 173.04823 134.1
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