CID 37662

2,3-dihydro-3-methyl-3-phenyl-1-(3-piperidinopropyl)-1h-indole maleate

Structural Information

Molecular Formula
C23H30N2
SMILES
CC1(CN(C2=CC=CC=C21)CCCN3CCCCC3)C4=CC=CC=C4
InChI
InChI=1S/C23H30N2/c1-23(20-11-4-2-5-12-20)19-25(22-14-7-6-13-21(22)23)18-10-17-24-15-8-3-9-16-24/h2,4-7,11-14H,3,8-10,15-19H2,1H3
InChIKey
GIPNBLMRZJYOFN-UHFFFAOYSA-N
Compound name
3-methyl-3-phenyl-1-(3-piperidin-1-ylpropyl)-2H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.2409 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.24818 185.9
[M+Na]+ 357.23012 189.9
[M-H]- 333.23362 191.9
[M+NH4]+ 352.27472 200.7
[M+K]+ 373.20406 183.1
[M+H-H2O]+ 317.23816 174.3
[M+HCOO]- 379.23910 200.6
[M+CH3COO]- 393.25475 194.2
[M+Na-2H]- 355.21557 186.4
[M]+ 334.24035 180.8
[M]- 334.24145 180.8
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.