CID 3087278

N,n-diethyl-6-(1h-indol-4-yl)-4-methyl-2-morpholinecarboxamide methanesulfonate

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

3
Patents

315.19467 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.20195 177.4
[M+Na]+ 338.18389 183.1
[M-H]- 314.18739 182.6
[M+NH4]+ 333.22849 190.3
[M+K]+ 354.15783 180.2
[M+H-H2O]+ 298.19193 168.3
[M+HCOO]- 360.19287 194.1
[M+CH3COO]- 374.20852 210.5
[M+Na-2H]- 336.16934 178.2
[M]+ 315.19412 177.5
[M]- 315.19522 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