CID 29462

3-(1-ethyl-2-pyrrolidinyl)indole hydrochloride

Structural Information

Molecular Formula
C14H18N2
SMILES
CCN1CCCC1C2=CNC3=CC=CC=C32
InChI
InChI=1S/C14H18N2/c1-2-16-9-5-8-14(16)12-10-15-13-7-4-3-6-11(12)13/h3-4,6-7,10,14-15H,2,5,8-9H2,1H3
InChIKey
PWMNSDRIYDELME-UHFFFAOYSA-N
Compound name
3-(1-ethylpyrrolidin-2-yl)-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.147 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.15428 149.3
[M+Na]+ 237.13622 157.6
[M-H]- 213.13972 153.2
[M+NH4]+ 232.18082 169.4
[M+K]+ 253.11016 152.7
[M+H-H2O]+ 197.14426 141.8
[M+HCOO]- 259.14520 169.6
[M+CH3COO]- 273.16085 161.7
[M+Na-2H]- 235.12167 151.8
[M]+ 214.14645 147.4
[M]- 214.14755 147.4
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