CID 214079

27674-55-1

Structural Information

Molecular Formula
C21H29NO2
SMILES
CCN(CC)CC(COC)C(C1=CC=CC=C1)(C2=CC=CC=C2)O
InChI
InChI=1S/C21H29NO2/c1-4-22(5-2)16-20(17-24-3)21(23,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,20,23H,4-5,16-17H2,1-3H3
InChIKey
TZHRLIANNQAHAU-UHFFFAOYSA-N
Compound name
2-(diethylaminomethyl)-3-methoxy-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.21982 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.22710 182.8
[M+Na]+ 350.20904 185.1
[M-H]- 326.21254 188.0
[M+NH4]+ 345.25364 195.7
[M+K]+ 366.18298 182.1
[M+H-H2O]+ 310.21708 174.1
[M+HCOO]- 372.21802 202.6
[M+CH3COO]- 386.23367 213.9
[M+Na-2H]- 348.19449 185.7
[M]+ 327.21927 184.6
[M]- 327.22037 184.6
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.