CID 101228

2,2-diethoxy-1,1-diphenyl-1-propanol

Structural Information

Molecular Formula
C19H24O3
SMILES
CCOC(C)(C(C1=CC=CC=C1)(C2=CC=CC=C2)O)OCC
InChI
InChI=1S/C19H24O3/c1-4-21-18(3,22-5-2)19(20,16-12-8-6-9-13-16)17-14-10-7-11-15-17/h6-15,20H,4-5H2,1-3H3
InChIKey
BCTYXOYLQMUBTP-UHFFFAOYSA-N
Compound name
2,2-diethoxy-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

300.17255 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.179826 173.2
[M+Na]+ 323.161768 177.8
[M-H]- 299.165274 177.8
[M+NH4]+ 318.206373 187.1
[M+K]+ 339.135708 174.6
[M+H-H2O]+ 283.169810 165.7
[M+HCOO]- 345.170751 191.8
[M+CH3COO]- 359.186401 201.4
[M+Na-2H]- 321.147216 179.7
[M]+ 300.17200142 175.4
[M]- 300.17309858 175.4
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

No patent data available for this compound.