CID 218993

41457-18-5

Structural Information

Molecular Formula
C19H31NO2
SMILES
CC1(CCC(N1CC(COCCC2=CC=CC=C2)O)(C)C)C
InChI
InChI=1S/C19H31NO2/c1-18(2)11-12-19(3,4)20(18)14-17(21)15-22-13-10-16-8-6-5-7-9-16/h5-9,17,21H,10-15H2,1-4H3
InChIKey
KMIRUPWDNWYLKH-UHFFFAOYSA-N
Compound name
1-(2-phenylethoxy)-3-(2,2,5,5-tetramethylpyrrolidin-1-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.23547 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.24275 176.2
[M+Na]+ 328.22469 186.1
[M+NH4]+ 323.26929 186.0
[M+K]+ 344.19863 177.4
[M-H]- 304.22819 178.2
[M+Na-2H]- 326.21014 183.3
[M]+ 305.23492 178.3
[M]- 305.23602 178.3
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.