CID 52195

Indecainide

Structural Information

Molecular Formula
C20H24N2O
SMILES
CC(C)NCCCC1(C2=CC=CC=C2C3=CC=CC=C31)C(=O)N
InChI
InChI=1S/C20H24N2O/c1-14(2)22-13-7-12-20(19(21)23)17-10-5-3-8-15(17)16-9-4-6-11-18(16)20/h3-6,8-11,14,22H,7,12-13H2,1-2H3,(H2,21,23)
InChIKey
UCEWGESNIULAGX-UHFFFAOYSA-N
Compound name
9-[3-(propan-2-ylamino)propyl]fluorene-9-carboxamide
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

28
References

1130
Patents

308.18887 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.19615 175.9
[M+Na]+ 331.17809 181.9
[M-H]- 307.18159 180.4
[M+NH4]+ 326.22269 195.6
[M+K]+ 347.15203 176.8
[M+H-H2O]+ 291.18613 169.0
[M+HCOO]- 353.18707 196.9
[M+CH3COO]- 367.20272 213.3
[M+Na-2H]- 329.16354 179.0
[M]+ 308.18832 176.1
[M]- 308.18942 176.1
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