CID 29462

19137-90-7

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

6
Patents

214.147 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.154276 149.3
[M+Na]+ 237.136218 157.6
[M-H]- 213.139724 153.2
[M+NH4]+ 232.180823 169.4
[M+K]+ 253.110158 152.7
[M+H-H2O]+ 197.144260 141.8
[M+HCOO]- 259.145201 169.6
[M+CH3COO]- 273.160851 161.7
[M+Na-2H]- 235.121666 151.8
[M]+ 214.14645142 147.4
[M]- 214.14754858 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