CID 611778

2-benzyl-4-methoxyphenol

Structural Information

Molecular Formula
C14H14O2
SMILES
COC1=CC(=C(C=C1)O)CC2=CC=CC=C2
InChI
InChI=1S/C14H14O2/c1-16-13-7-8-14(15)12(10-13)9-11-5-3-2-4-6-11/h2-8,10,15H,9H2,1H3
InChIKey
ZCVHLCUGDIPDLI-UHFFFAOYSA-N
Compound name
2-benzyl-4-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

214.09938 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.106656 146.2
[M+Na]+ 237.088598 154.3
[M-H]- 213.092104 152.0
[M+NH4]+ 232.133203 164.4
[M+K]+ 253.062538 150.7
[M+H-H2O]+ 197.096640 139.4
[M+HCOO]- 259.097581 169.6
[M+CH3COO]- 273.113231 185.8
[M+Na-2H]- 235.074046 152.5
[M]+ 214.09883142 147.1
[M]- 214.09992858 147.1
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