CID 46784145

2287315-98-2

Structural Information

Molecular Formula

C₁₂H₁₄N₂

SMILES

C1CC1NCC2=CC3=CC=CC=C3N2

InChI

InChI=1S/C12H14N2/c1-2-4-12-9(3-1)7-11(14-12)8-13-10-5-6-10/h1-4,7,10,13-14H,5-6,8H2

InChIKey

LJBSGGMAGATZTF-UHFFFAOYSA-N

Compound name

N-(1H-indol-2-ylmethyl)cyclopropanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 186.11569 Da
Monoisotopic Mass: 2.1
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]+	187.12297	141.3
[M+Na]+	209.10491	155.6
[M+NH4]+	204.14951	151.4
[M+K]+	225.07885	150.9
[M-H]-	185.10841	152.1
[M+Na-2H]-	207.09036	151.7
[M]+	186.11514	147.5
[M]-	186.11624	147.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe