CID 211411

23044-44-2

Structural Information

Molecular Formula
C19H23NO3
SMILES
COC1=CC=CC=C1OC2CCN(C2)CCOC3=CC=CC=C3
InChI
InChI=1S/C19H23NO3/c1-21-18-9-5-6-10-19(18)23-17-11-12-20(15-17)13-14-22-16-7-3-2-4-8-16/h2-10,17H,11-15H2,1H3
InChIKey
MQSDPXIWALGDAQ-UHFFFAOYSA-N
Compound name
3-(2-methoxyphenoxy)-1-(2-phenoxyethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.1678 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.175076 174.2
[M+Na]+ 336.157018 179.2
[M-H]- 312.160524 181.8
[M+NH4]+ 331.201623 188.5
[M+K]+ 352.130958 175.7
[M+H-H2O]+ 296.165060 164.5
[M+HCOO]- 358.166001 195.4
[M+CH3COO]- 372.181651 204.3
[M+Na-2H]- 334.142466 175.8
[M]+ 313.16725142 175.7
[M]- 313.16834858 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.