CID 601250

2-ethoxy-4-prop-2-enylphenol

Structural Information

Molecular Formula
C11H14O2
SMILES
CCOC1=C(C=CC(=C1)CC=C)O
InChI
InChI=1S/C11H14O2/c1-3-5-9-6-7-10(12)11(8-9)13-4-2/h3,6-8,12H,1,4-5H2,2H3
InChIKey
LEXYYUGWWDAGQB-UHFFFAOYSA-N
Compound name
2-ethoxy-4-prop-2-enylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

178.09938 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.106656 137.5
[M+Na]+ 201.088598 145.9
[M-H]- 177.092104 140.2
[M+NH4]+ 196.133203 157.5
[M+K]+ 217.062538 143.1
[M+H-H2O]+ 161.096640 132.2
[M+HCOO]- 223.097581 160.7
[M+CH3COO]- 237.113231 180.2
[M+Na-2H]- 199.074046 142.9
[M]+ 178.09883142 139.3
[M]- 178.09992858 139.3
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