CID 3087278

113760-34-2

Structural Information

Molecular Formula
C18H25N3O2
SMILES
CCN(CC)C(=O)C1CN(CC(O1)C2=C3C=CNC3=CC=C2)C
InChI
InChI=1S/C18H25N3O2/c1-4-21(5-2)18(22)17-12-20(3)11-16(23-17)14-7-6-8-15-13(14)9-10-19-15/h6-10,16-17,19H,4-5,11-12H2,1-3H3
InChIKey
WDDNSSDFEAIBRX-UHFFFAOYSA-N
Compound name
N,N-diethyl-6-(1H-indol-4-yl)-4-methylmorpholine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

315.19467 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.201946 177.4
[M+Na]+ 338.183888 183.1
[M-H]- 314.187394 182.6
[M+NH4]+ 333.228493 190.3
[M+K]+ 354.157828 180.2
[M+H-H2O]+ 298.191930 168.3
[M+HCOO]- 360.192871 194.1
[M+CH3COO]- 374.208521 210.5
[M+Na-2H]- 336.169336 178.2
[M]+ 315.19412142 177.5
[M]- 315.19521858 177.5
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

patents stripe