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]+ 340.227096 184.9
[M+Na]+ 362.209038 186.5
[M-H]- 338.212544 190.2
[M+NH4]+ 357.253643 196.8
[M+K]+ 378.182978 181.8
[M+H-H2O]+ 322.217080 175.4
[M+HCOO]- 384.218021 200.7
[M+CH3COO]- 398.233671 207.6
[M+Na-2H]- 360.194486 185.6
[M]+ 339.21927142 182.2
[M]- 339.22036858 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.