CID 21889199

2759-12-8

Structural Information

Molecular Formula

C₈H₁₀N₂

SMILES

C1CNC2=C1C=CC=C2N

InChI

InChI=1S/C8H10N2/c9-7-3-1-2-6-4-5-10-8(6)7/h1-3,10H,4-5,9H2

InChIKey

BZJFJABOZCGZDD-UHFFFAOYSA-N

Compound name

2,3-dihydro-1H-indol-7-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 123
Patents: 134.0844 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]+	135.09168	125.4
[M+Na]+	157.07362	133.4
[M-H]-	133.07712	126.9
[M+NH4]+	152.11822	147.8
[M+K]+	173.04756	129.9
[M+H-H2O]+	117.08166	119.6
[M+HCOO]-	179.08260	147.3
[M+CH3COO]-	193.09825	138.9
[M+Na-2H]-	155.05907	132.2
[M]+	134.08385	120.5
[M]-	134.08495	120.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe