CID 12437302

2,2-dimethylindoline

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

CC1(CC2=CC=CC=C2N1)C

InChI

InChI=1S/C10H13N/c1-10(2)7-8-5-3-4-6-9(8)11-10/h3-6,11H,7H2,1-2H3

InChIKey

RXCOLBXGORCBMP-UHFFFAOYSA-N

Compound name

2,2-dimethyl-1,3-dihydroindole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 104
Patents: 147.1048 Da
Monoisotopic Mass: 2.6
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	131.4
[M+Na]+	170.09402	144.0
[M+NH4]+	165.13862	142.8
[M+K]+	186.06796	136.7
[M-H]-	146.09752	133.6
[M+Na-2H]-	168.07947	138.9
[M]+	147.10425	134.0
[M]-	147.10535	134.0

Literature stripe

literature stripe

Patent stripe

patents stripe