CID 19340

Indole, 3-(1-(2-morpholinoethyl)-3-pyrrolidinyl)-, dihydrochloride

Structural Information

Molecular Formula
C18H25N3O
SMILES
C1CN(CC1C2=CNC3=CC=CC=C32)CCN4CCOCC4
InChI
InChI=1S/C18H25N3O/c1-2-4-18-16(3-1)17(13-19-18)15-5-6-21(14-15)8-7-20-9-11-22-12-10-20/h1-4,13,15,19H,5-12,14H2
InChIKey
JMFQVIVSVILMKK-UHFFFAOYSA-N
Compound name
4-[2-[3-(1H-indol-3-yl)pyrrolidin-1-yl]ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

299.19977 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.20705 170.9
[M+Na]+ 322.18899 175.6
[M-H]- 298.19249 175.9
[M+NH4]+ 317.23359 183.9
[M+K]+ 338.16293 171.0
[M+H-H2O]+ 282.19703 161.0
[M+HCOO]- 344.19797 184.7
[M+CH3COO]- 358.21362 180.0
[M+Na-2H]- 320.17444 170.4
[M]+ 299.19922 166.0
[M]- 299.20032 166.0
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.