CID 75361273

1439903-99-7

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

C1CC1C2=CC=C(C=C2)CCN

InChI

InChI=1S/C11H15N/c12-8-7-9-1-3-10(4-2-9)11-5-6-11/h1-4,11H,5-8,12H2

InChIKey

GWIGMSLOVHFVBD-UHFFFAOYSA-N

Compound name

2-(4-cyclopropylphenyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 12
Patents: 161.12045 Da
Monoisotopic Mass: 2.2
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]+	162.12773	131.5
[M+Na]+	184.10967	140.2
[M-H]-	160.11317	138.7
[M+NH4]+	179.15427	147.3
[M+K]+	200.08361	136.7
[M+H-H2O]+	144.11771	125.0
[M+HCOO]-	206.11865	156.6
[M+CH3COO]-	220.13430	184.4
[M+Na-2H]-	182.09512	138.2
[M]+	161.11990	132.1
[M]-	161.12100	132.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe