CID 12203498

2-methylbenzofuran-6-ol

Structural Information

Molecular Formula
C9H8O2
SMILES
CC1=CC2=C(O1)C=C(C=C2)O
InChI
InChI=1S/C9H8O2/c1-6-4-7-2-3-8(10)5-9(7)11-6/h2-5,10H,1H3
InChIKey
ASUDREWVUSTLJP-UHFFFAOYSA-N
Compound name
2-methyl-1-benzofuran-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

84
Patents

148.05243 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.05971 124.5
[M+Na]+ 171.04165 136.0
[M-H]- 147.04515 129.8
[M+NH4]+ 166.08625 147.6
[M+K]+ 187.01559 134.4
[M+H-H2O]+ 131.04969 120.3
[M+HCOO]- 193.05063 149.4
[M+CH3COO]- 207.06628 172.1
[M+Na-2H]- 169.02710 133.7
[M]+ 148.05188 128.0
[M]- 148.05298 128.0
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