CID 5274974

5-ethyl-2-phenoxyphenol

Structural Information

Molecular Formula
C14H14O2
SMILES
CCC1=CC(=C(C=C1)OC2=CC=CC=C2)O
InChI
InChI=1S/C14H14O2/c1-2-11-8-9-14(13(15)10-11)16-12-6-4-3-5-7-12/h3-10,15H,2H2,1H3
InChIKey
XZOPHRPAUNJURP-UHFFFAOYSA-N
Compound name
5-ethyl-2-phenoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

10
Patents

214.09938 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.10666 147.2
[M+Na]+ 237.08860 162.6
[M+NH4]+ 232.13320 156.5
[M+K]+ 253.06254 154.5
[M-H]- 213.09210 152.1
[M+Na-2H]- 235.07405 157.2
[M]+ 214.09883 151.0
[M]- 214.09993 151.0
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