CID 18435788

Spiro[indole-3,4'-piperidin]-2(1h)-one hydrochloride

Structural Information

Molecular Formula
C12H14N2O
SMILES
C1CNCCC12C3=CC=CC=C3NC2=O
InChI
InChI=1S/C12H14N2O/c15-11-12(5-7-13-8-6-12)9-3-1-2-4-10(9)14-11/h1-4,13H,5-8H2,(H,14,15)
InChIKey
SXOVJOBXZPCKRA-UHFFFAOYSA-N
Compound name
spiro[1H-indole-3,4'-piperidine]-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

283
Patents

202.11061 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.117886 146.2
[M+Na]+ 225.099828 153.1
[M-H]- 201.103334 146.9
[M+NH4]+ 220.144433 166.0
[M+K]+ 241.073768 147.6
[M+H-H2O]+ 185.107870 138.8
[M+HCOO]- 247.108811 160.8
[M+CH3COO]- 261.124461 156.9
[M+Na-2H]- 223.085276 151.3
[M]+ 202.11006142 137.9
[M]- 202.11115858 137.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe