CID 4133183

2-(2,3-dihydro-1-benzofuran-5-yl)phenol

Structural Information

Molecular Formula
C14H12O2
SMILES
C1COC2=C1C=C(C=C2)C3=CC=CC=C3O
InChI
InChI=1S/C14H12O2/c15-13-4-2-1-3-12(13)10-5-6-14-11(9-10)7-8-16-14/h1-6,9,15H,7-8H2
InChIKey
ZSUNTFZAYSYOPO-UHFFFAOYSA-N
Compound name
2-(2,3-dihydro-1-benzofuran-5-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.08372 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.090996 143.8
[M+Na]+ 235.072938 152.4
[M-H]- 211.076444 151.2
[M+NH4]+ 230.117543 163.5
[M+K]+ 251.046878 149.3
[M+H-H2O]+ 195.080980 137.9
[M+HCOO]- 257.081921 165.5
[M+CH3COO]- 271.097571 157.5
[M+Na-2H]- 233.058386 150.3
[M]+ 212.08317142 143.5
[M]- 212.08426858 143.5
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