CID 115779370

1-(1-methylcyclopentyl)ethan-1-amine

Structural Information

Molecular Formula

C₈H₁₇N

SMILES

CC(C1(CCCC1)C)N

InChI

InChI=1S/C8H17N/c1-7(9)8(2)5-3-4-6-8/h7H,3-6,9H2,1-2H3

InChIKey

AQYVIQWTSBBRFM-UHFFFAOYSA-N

Compound name

1-(1-methylcyclopentyl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 127.1361 Da
Monoisotopic Mass: 1.9
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]+	128.14338	130.0
[M+Na]+	150.12532	138.5
[M+NH4]+	145.16992	140.6
[M+K]+	166.09926	133.0
[M-H]-	126.12882	132.0
[M+Na-2H]-	148.11077	135.7
[M]+	127.13555	131.7
[M]-	127.13665	131.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe