CID 218972

41456-88-6

Structural Information

Molecular Formula
C19H31NO2
SMILES
CC1=CC(=C(C=C1)OCC(CN2C(CCC2(C)C)(C)C)O)C
InChI
InChI=1S/C19H31NO2/c1-14-7-8-17(15(2)11-14)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
VGHSEOABZPWSGN-UHFFFAOYSA-N
Compound name
1-(2,4-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 172.8
[M+Na]+ 328.22469 180.0
[M-H]- 304.22819 177.0
[M+NH4]+ 323.26929 192.3
[M+K]+ 344.19863 176.8
[M+H-H2O]+ 288.23273 167.1
[M+HCOO]- 350.23367 190.1
[M+CH3COO]- 364.24932 206.4
[M+Na-2H]- 326.21014 172.3
[M]+ 305.23492 174.9
[M]- 305.23602 174.9
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.