CID 21095

2-indolinone, 3-(2-aminoethyl)-, hydrochloride

Structural Information

Molecular Formula
C10H12N2O
SMILES
C1=CC=C2C(=C1)C(C(=O)N2)CCN
InChI
InChI=1S/C10H12N2O/c11-6-5-8-7-3-1-2-4-9(7)12-10(8)13/h1-4,8H,5-6,11H2,(H,12,13)
InChIKey
SZDFIVJGWVHZAV-UHFFFAOYSA-N
Compound name
3-(2-aminoethyl)-1,3-dihydroindol-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

24
Patents

176.09496 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 136.9
[M+Na]+ 199.08418 145.1
[M-H]- 175.08768 138.4
[M+NH4]+ 194.12878 157.7
[M+K]+ 215.05812 141.0
[M+H-H2O]+ 159.09222 130.9
[M+HCOO]- 221.09316 158.4
[M+CH3COO]- 235.10881 179.7
[M+Na-2H]- 197.06963 141.8
[M]+ 176.09441 133.8
[M]- 176.09551 133.8
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