CID 244856

3-((dimethylamino)acetyl)-1-methyl-1,3-dihydro-2h-indol-2-one

Structural Information

Molecular Formula
C13H16N2O2
SMILES
CN1C2=CC=CC=C2C(C1=O)C(=O)CN(C)C
InChI
InChI=1S/C13H16N2O2/c1-14(2)8-11(16)12-9-6-4-5-7-10(9)15(3)13(12)17/h4-7,12H,8H2,1-3H3
InChIKey
VZFMPZXNSCIZHB-UHFFFAOYSA-N
Compound name
3-[2-(dimethylamino)acetyl]-1-methyl-3H-indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.12119 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.12847 151.8
[M+Na]+ 255.11041 160.0
[M-H]- 231.11391 156.7
[M+NH4]+ 250.15501 172.0
[M+K]+ 271.08435 158.3
[M+H-H2O]+ 215.11845 145.2
[M+HCOO]- 277.11939 174.3
[M+CH3COO]- 291.13504 198.7
[M+Na-2H]- 253.09586 154.1
[M]+ 232.12064 154.3
[M]- 232.12174 154.3
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.