CID 135442

2-ethenylphenol

Structural Information

Molecular Formula
C8H8O
SMILES
C=CC1=CC=CC=C1O
InChI
InChI=1S/C8H8O/c1-2-7-5-3-4-6-8(7)9/h2-6,9H,1H2
InChIKey
JESXATFQYMPTNL-UHFFFAOYSA-N
Compound name
2-ethenylphenol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

8
References

70763
Patents

120.05752 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.06480 120.9
[M+Na]+ 143.04674 129.6
[M-H]- 119.05024 123.7
[M+NH4]+ 138.09134 142.9
[M+K]+ 159.02068 127.0
[M+H-H2O]+ 103.05478 116.2
[M+HCOO]- 165.05572 144.8
[M+CH3COO]- 179.07137 167.9
[M+Na-2H]- 141.03219 128.7
[M]+ 120.05697 119.7
[M]- 120.05807 119.7
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

No patent data available for this compound.