CID 34865

Ketone, 3-indolyl morpholinomethyl

Structural Information

Molecular Formula
C14H16N2O2
SMILES
C1COCCN1CC(=O)C2=CNC3=CC=CC=C32
InChI
InChI=1S/C14H16N2O2/c17-14(10-16-5-7-18-8-6-16)12-9-15-13-4-2-1-3-11(12)13/h1-4,9,15H,5-8,10H2
InChIKey
RMPYPIVZYUDLIM-UHFFFAOYSA-N
Compound name
1-(1H-indol-3-yl)-2-morpholin-4-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

3
Patents

244.12119 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.128466 154.1
[M+Na]+ 267.110408 160.5
[M-H]- 243.113914 157.8
[M+NH4]+ 262.155013 169.0
[M+K]+ 283.084348 157.2
[M+H-H2O]+ 227.118450 145.7
[M+HCOO]- 289.119391 170.7
[M+CH3COO]- 303.135041 165.1
[M+Na-2H]- 265.095856 158.6
[M]+ 244.12064142 151.5
[M]- 244.12173858 151.5
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

patents stripe