CID 22692471

5-amino-1-ethyl-2,3-dihydro-1h-indol-2-one hydrochloride

Structural Information

Molecular Formula
C10H12N2O
SMILES
CCN1C(=O)CC2=C1C=CC(=C2)N
InChI
InChI=1S/C10H12N2O/c1-2-12-9-4-3-8(11)5-7(9)6-10(12)13/h3-5H,2,6,11H2,1H3
InChIKey
PYVVLSILSIVNQC-UHFFFAOYSA-N
Compound name
5-amino-1-ethyl-3H-indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

43
Patents

176.09496 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.102236 136.6
[M+Na]+ 199.084178 146.1
[M-H]- 175.087684 139.9
[M+NH4]+ 194.128783 158.4
[M+K]+ 215.058118 142.9
[M+H-H2O]+ 159.092220 130.6
[M+HCOO]- 221.093161 159.6
[M+CH3COO]- 235.108811 183.4
[M+Na-2H]- 197.069626 141.2
[M]+ 176.09441142 135.6
[M]- 176.09550858 135.6
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