CID 58448136

4-cyclopropylindoline

Structural Information

Molecular Formula

C₁₁H₁₃N

SMILES

C1CC1C2=C3CCNC3=CC=C2

InChI

InChI=1S/C11H13N/c1-2-9(8-4-5-8)10-6-7-12-11(10)3-1/h1-3,8,12H,4-7H2

InChIKey

TXIBMTPLWKDOCV-UHFFFAOYSA-N

Compound name

4-cyclopropyl-2,3-dihydro-1H-indole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 159.1048 Da
Monoisotopic Mass: 2.9
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]+	160.11208	136.1
[M+Na]+	182.09402	150.1
[M+NH4]+	177.13862	146.8
[M+K]+	198.06796	145.6
[M-H]-	158.09752	146.5
[M+Na-2H]-	180.07947	145.4
[M]+	159.10425	142.2
[M]-	159.10535	142.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe