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]+ 314.17508 174.2
[M+Na]+ 336.15702 179.2
[M-H]- 312.16052 181.8
[M+NH4]+ 331.20162 188.5
[M+K]+ 352.13096 175.7
[M+H-H2O]+ 296.16506 164.5
[M+HCOO]- 358.16600 195.4
[M+CH3COO]- 372.18165 204.3
[M+Na-2H]- 334.14247 175.8
[M]+ 313.16725 175.7
[M]- 313.16835 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.