CID 103509

Einecs 257-354-6

Structural Information

Molecular Formula
C19H20O3
SMILES
C1CCOC(C1)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C19H20O3/c20-18(15-9-3-1-4-10-15)19(16-11-5-2-6-12-16)22-17-13-7-8-14-21-17/h1-6,9-12,17,19H,7-8,13-14H2
InChIKey
DNNDHIKCLIZHBH-UHFFFAOYSA-N
Compound name
2-(oxan-2-yloxy)-1,2-diphenylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

963
Patents

296.14124 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.14852 169.7
[M+Na]+ 319.13046 171.8
[M-H]- 295.13396 178.3
[M+NH4]+ 314.17506 181.8
[M+K]+ 335.10440 169.9
[M+H-H2O]+ 279.13850 160.3
[M+HCOO]- 341.13944 187.2
[M+CH3COO]- 355.15509 201.1
[M+Na-2H]- 317.11591 172.7
[M]+ 296.14069 166.2
[M]- 296.14179 166.2
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