CID 14134

1084-47-5

Structural Information

Molecular Formula

C₁₃H₁₄N₂O₂

SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(=O)N(C)C

InChI

InChI=1S/C13H14N2O2/c1-8-11(12(16)13(17)15(2)3)9-6-4-5-7-10(9)14-8/h4-7,14H,1-3H3

InChIKey

CBMCIRIKRUXCDP-UHFFFAOYSA-N

Compound name

N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 230.10553 Da
Monoisotopic Mass: 1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	231.11281	150.9
[M+Na]+	253.09475	159.5
[M-H]-	229.09825	155.0
[M+NH4]+	248.13935	170.3
[M+K]+	269.06869	157.1
[M+H-H2O]+	213.10279	144.3
[M+HCOO]-	275.10373	173.7
[M+CH3COO]-	289.11938	194.6
[M+Na-2H]-	251.08020	154.1
[M]+	230.10498	153.3
[M]-	230.10608	153.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe