CID 218981

41456-97-7

Structural Information

Molecular Formula
C18H29NO3
SMILES
CC1(CCC(N1CC(COC2=CC=CC=C2OC)O)(C)C)C
InChI
InChI=1S/C18H29NO3/c1-17(2)10-11-18(3,4)19(17)12-14(20)13-22-16-9-7-6-8-15(16)21-5/h6-9,14,20H,10-13H2,1-5H3
InChIKey
RHSOSPVCQQWPKZ-UHFFFAOYSA-N
Compound name
1-(2-methoxyphenoxy)-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

307.21475 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.22203 172.9
[M+Na]+ 330.20397 179.5
[M-H]- 306.20747 176.9
[M+NH4]+ 325.24857 191.9
[M+K]+ 346.17791 177.0
[M+H-H2O]+ 290.21201 166.8
[M+HCOO]- 352.21295 190.8
[M+CH3COO]- 366.22860 204.2
[M+Na-2H]- 328.18942 173.6
[M]+ 307.21420 175.7
[M]- 307.21530 175.7
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.