CID 3067855

Alpha-(4-methylphenyl)-2-benzofuranmethanol

Structural Information

Molecular Formula
C16H14O2
SMILES
CC1=CC=C(C=C1)C(C2=CC3=CC=CC=C3O2)O
InChI
InChI=1S/C16H14O2/c1-11-6-8-12(9-7-11)16(17)15-10-13-4-2-3-5-14(13)18-15/h2-10,16-17H,1H3
InChIKey
TVONMLOGRLGDHE-UHFFFAOYSA-N
Compound name
1-benzofuran-2-yl-(4-methylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

238.09938 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.10666 151.7
[M+Na]+ 261.08860 167.5
[M+NH4]+ 256.13320 161.5
[M+K]+ 277.06254 161.7
[M-H]- 237.09210 158.0
[M+Na-2H]- 259.07405 160.6
[M]+ 238.09883 156.0
[M]- 238.09993 156.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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