CID 30944

2,3-dimethylindoline

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

CC1C(NC2=CC=CC=C12)C

InChI

InChI=1S/C10H13N/c1-7-8(2)11-10-6-4-3-5-9(7)10/h3-8,11H,1-2H3

InChIKey

NNPSOAOENINXMR-UHFFFAOYSA-N

Compound name

2,3-dimethyl-2,3-dihydro-1H-indole

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 215
Patents: 147.1048 Da
Monoisotopic Mass: 2.7
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]+	148.11208	130.9
[M+Na]+	170.09402	143.7
[M+NH4]+	165.13862	140.8
[M+K]+	186.06796	138.3
[M-H]-	146.09752	133.1
[M+Na-2H]-	168.07947	136.6
[M]+	147.10425	133.3
[M]-	147.10535	133.3

Literature stripe

literature stripe

Patent stripe

patents stripe