CID 559512

Brn 5447870

Structural Information

Molecular Formula
C21H25N3O
SMILES
CCN(CC)CC(=O)NC1=C(C2=CC=CC=C2N1C3=CC=CC=C3)C
InChI
InChI=1S/C21H25N3O/c1-4-23(5-2)15-20(25)22-21-16(3)18-13-9-10-14-19(18)24(21)17-11-7-6-8-12-17/h6-14H,4-5,15H2,1-3H3,(H,22,25)
InChIKey
SQXYABOOUPGUBG-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-(3-methyl-1-phenylindol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.19977 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.20705 182.9
[M+Na]+ 358.18899 195.9
[M+NH4]+ 353.23359 190.8
[M+K]+ 374.16293 189.5
[M-H]- 334.19249 188.3
[M+Na-2H]- 356.17444 190.7
[M]+ 335.19922 186.3
[M]- 335.20032 186.3
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

No patent data available for this compound.