CID 29451

19137-65-6

Structural Information

Molecular Formula
C13H16N2
SMILES
CC1CCC(N1)C2=CNC3=CC=CC=C32
InChI
InChI=1S/C13H16N2/c1-9-6-7-13(15-9)11-8-14-12-5-3-2-4-10(11)12/h2-5,8-9,13-15H,6-7H2,1H3
InChIKey
CHSUKXFCIFJYJL-UHFFFAOYSA-N
Compound name
3-(5-methylpyrrolidin-2-yl)-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

200.13135 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.138626 145.0
[M+Na]+ 223.120568 153.4
[M-H]- 199.124074 147.8
[M+NH4]+ 218.165173 164.9
[M+K]+ 239.094508 147.8
[M+H-H2O]+ 183.128610 138.0
[M+HCOO]- 245.129551 164.2
[M+CH3COO]- 259.145201 157.1
[M+Na-2H]- 221.106016 147.7
[M]+ 200.13080142 141.0
[M]- 200.13189858 141.0
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