CID 12415229

67242-60-8

Structural Information

Molecular Formula

C₁₀H₁₀N₂O

SMILES

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

InChI

InChI=1S/C10H10N2O/c1-6-9(10(11)13)7-4-2-3-5-8(7)12-6/h2-5,12H,1H3,(H2,11,13)

InChIKey

QKWLFJZXUBMFLU-UHFFFAOYSA-N

Compound name

2-methyl-1H-indole-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 36
Patents: 174.07932 Da
Monoisotopic Mass: 1.3
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]+	175.08660	135.1
[M+Na]+	197.06854	147.4
[M+NH4]+	192.11314	143.5
[M+K]+	213.04248	143.5
[M-H]-	173.07204	136.8
[M+Na-2H]-	195.05399	140.9
[M]+	174.07877	137.1
[M]-	174.07987	137.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe