CID 213587

Brn 0434025

Structural Information

Molecular Formula
C19H27N3O2
SMILES
CC1=C(C2=C(N1)C=CC(=C2)OC)CCN3CCC(CC3)NC(=O)C
InChI
InChI=1S/C19H27N3O2/c1-13-17(18-12-16(24-3)4-5-19(18)20-13)8-11-22-9-6-15(7-10-22)21-14(2)23/h4-5,12,15,20H,6-11H2,1-3H3,(H,21,23)
InChIKey
GLYFMAIZDDRWSD-UHFFFAOYSA-N
Compound name
N-[1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]piperidin-4-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

329.21033 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.21761 180.9
[M+Na]+ 352.19955 186.7
[M-H]- 328.20305 184.2
[M+NH4]+ 347.24415 194.2
[M+K]+ 368.17349 181.4
[M+H-H2O]+ 312.20759 171.9
[M+HCOO]- 374.20853 197.7
[M+CH3COO]- 388.22418 211.3
[M+Na-2H]- 350.18500 180.8
[M]+ 329.20978 179.9
[M]- 329.21088 179.9
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