CID 10561211

1-(4-(p-tolyloxy)phenyl)ethanone

Structural Information

Molecular Formula
C15H14O2
SMILES
CC1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)C
InChI
InChI=1S/C15H14O2/c1-11-3-7-14(8-4-11)17-15-9-5-13(6-10-15)12(2)16/h3-10H,1-2H3
InChIKey
CAZWIMGCKKDNSZ-UHFFFAOYSA-N
Compound name
1-[4-(4-methylphenoxy)phenyl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

162
Patents

226.09938 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.10666 150.3
[M+Na]+ 249.08860 165.6
[M+NH4]+ 244.13320 159.3
[M+K]+ 265.06254 157.8
[M-H]- 225.09210 155.1
[M+Na-2H]- 247.07405 160.1
[M]+ 226.09883 154.0
[M]- 226.09993 154.0
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

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