CID 59727795

900800-35-3

Structural Information

Molecular Formula
C11H14O2
SMILES
COC1=C(C=C(C=C1)CO)CC=C
InChI
InChI=1S/C11H14O2/c1-3-4-10-7-9(8-12)5-6-11(10)13-2/h3,5-7,12H,1,4,8H2,2H3
InChIKey
RZVWSNLSBMQBSJ-UHFFFAOYSA-N
Compound name
(4-methoxy-3-prop-2-enylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

178.09938 Da
Monoisotopic Mass

2.1
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

No literature data available for this compound.

Patent stripe

patents stripe