CID 290000

33037-89-7

Structural Information

Molecular Formula
C20H26N2O4
SMILES
CCOC(=O)CN1CCC(CC1)C2(OCCO2)C3=CC4=CC=CC=C4N3
InChI
InChI=1S/C20H26N2O4/c1-2-24-19(23)14-22-9-7-16(8-10-22)20(25-11-12-26-20)18-13-15-5-3-4-6-17(15)21-18/h3-6,13,16,21H,2,7-12,14H2,1H3
InChIKey
NWKDRRZKIAMEOA-UHFFFAOYSA-N
Compound name
ethyl 2-[4-[2-(1H-indol-2-yl)-1,3-dioxolan-2-yl]piperidin-1-yl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

358.18927 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.19655 183.9
[M+Na]+ 381.17849 188.5
[M-H]- 357.18199 191.1
[M+NH4]+ 376.22309 196.2
[M+K]+ 397.15243 186.5
[M+H-H2O]+ 341.18653 175.6
[M+HCOO]- 403.18747 197.1
[M+CH3COO]- 417.20312 192.9
[M+Na-2H]- 379.16394 183.5
[M]+ 358.18872 182.9
[M]- 358.18982 182.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.