CID 29458

3-(1,5,5-trimethylpyrrolidin-2-yl)-1h-indole

Structural Information

Molecular Formula
C15H20N2
SMILES
CC1(CCC(N1C)C2=CNC3=CC=CC=C32)C
InChI
InChI=1S/C15H20N2/c1-15(2)9-8-14(17(15)3)12-10-16-13-7-5-4-6-11(12)13/h4-7,10,14,16H,8-9H2,1-3H3
InChIKey
CTLWQMICLDLMLR-UHFFFAOYSA-N
Compound name
3-(1,5,5-trimethylpyrrolidin-2-yl)-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.16264 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.16992 153.0
[M+Na]+ 251.15186 166.0
[M+NH4]+ 246.19646 163.6
[M+K]+ 267.12580 160.2
[M-H]- 227.15536 156.2
[M+Na-2H]- 249.13731 160.5
[M]+ 228.16209 155.9
[M]- 228.16319 155.9
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.

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No patent data available for this compound.