CID 137018

1-ethylcyclopentanol

Structural Information

Molecular Formula

C₇H₁₄O

SMILES

CCC1(CCCC1)O

InChI

InChI=1S/C7H14O/c1-2-7(8)5-3-4-6-7/h8H,2-6H2,1H3

InChIKey

LPCWIFPJLFCXRS-UHFFFAOYSA-N

Compound name

1-ethylcyclopentan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2596
Patents: 114.10446 Da
Monoisotopic Mass: 1.5
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]+	115.11174	125.1
[M+Na]+	137.09368	134.7
[M+NH4]+	132.13828	135.7
[M+K]+	153.06762	128.8
[M-H]-	113.09718	126.2
[M+Na-2H]-	135.07913	131.1
[M]+	114.10391	126.7
[M]-	114.10501	126.7

Literature stripe

literature stripe

Patent stripe

patents stripe