CID 214085

27674-58-4

Structural Information

Molecular Formula
C22H29NO2
SMILES
CCOCC(CN1CCCC1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChI
InChI=1S/C22H29NO2/c1-2-25-18-21(17-23-15-9-10-16-23)22(24,19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-8,11-14,21,24H,2,9-10,15-18H2,1H3
InChIKey
MARVYURKKIEMKH-UHFFFAOYSA-N
Compound name
2-(ethoxymethyl)-1,1-diphenyl-3-pyrrolidin-1-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.21982 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.22710 184.9
[M+Na]+ 362.20904 186.5
[M-H]- 338.21254 190.2
[M+NH4]+ 357.25364 196.8
[M+K]+ 378.18298 181.8
[M+H-H2O]+ 322.21708 175.4
[M+HCOO]- 384.21802 200.7
[M+CH3COO]- 398.23367 207.6
[M+Na-2H]- 360.19449 185.6
[M]+ 339.21927 182.2
[M]- 339.22037 182.2
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.