CID 3084853

41996-78-5

Structural Information

Molecular Formula
C18H20O3
SMILES
CCOC(C1=CC=CC=C1)(C(=O)C2=CC=CC=C2)OCC
InChI
InChI=1S/C18H20O3/c1-3-20-18(21-4-2,16-13-9-6-10-14-16)17(19)15-11-7-5-8-12-15/h5-14H,3-4H2,1-2H3
InChIKey
GIMQKKFOOYOQGB-UHFFFAOYSA-N
Compound name
2,2-diethoxy-1,2-diphenylethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

11431
Patents

284.14124 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.148516 167.5
[M+Na]+ 307.130458 172.6
[M-H]- 283.133964 173.5
[M+NH4]+ 302.175063 182.6
[M+K]+ 323.104398 169.9
[M+H-H2O]+ 267.138500 159.6
[M+HCOO]- 329.139441 188.8
[M+CH3COO]- 343.155091 200.5
[M+Na-2H]- 305.115906 172.9
[M]+ 284.14069142 170.4
[M]- 284.14178858 170.4
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