CID 218978

41456-91-1

Structural Information

Molecular Formula
C19H31NO2
SMILES
CC1=C(C=C(C=C1)OCC(CN2C(CCC2(C)C)(C)C)O)C
InChI
InChI=1S/C19H31NO2/c1-14-7-8-17(11-15(14)2)22-13-16(21)12-20-18(3,4)9-10-19(20,5)6/h7-8,11,16,21H,9-10,12-13H2,1-6H3
InChIKey
IAWDQHNVXICIQS-UHFFFAOYSA-N
Compound name
1-(3,4-dimethylphenoxy)-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

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.24275 174.8
[M+Na]+ 328.22469 185.4
[M+NH4]+ 323.26929 184.6
[M+K]+ 344.19863 177.3
[M-H]- 304.22819 177.0
[M+Na-2H]- 326.21014 181.6
[M]+ 305.23492 177.2
[M]- 305.23602 177.2
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.