CID 43119624

5-(1-aminoethyl)-1-methyl-2,3-dihydro-1h-indol-2-one hydrochloride

Structural Information

Molecular Formula
C11H14N2O
SMILES
CC(C1=CC2=C(C=C1)N(C(=O)C2)C)N
InChI
InChI=1S/C11H14N2O/c1-7(12)8-3-4-10-9(5-8)6-11(14)13(10)2/h3-5,7H,6,12H2,1-2H3
InChIKey
AVYYGYRFEPCUGG-UHFFFAOYSA-N
Compound name
5-(1-aminoethyl)-1-methyl-3H-indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.11061 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 141.7
[M+Na]+ 213.09983 150.6
[M-H]- 189.10333 145.0
[M+NH4]+ 208.14443 162.9
[M+K]+ 229.07377 147.6
[M+H-H2O]+ 173.10787 135.7
[M+HCOO]- 235.10881 163.4
[M+CH3COO]- 249.12446 187.4
[M+Na-2H]- 211.08528 144.6
[M]+ 190.11006 140.5
[M]- 190.11116 140.5
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

No patent data available for this compound.