CID 21360968

(1-ethylcyclopentyl)methanol

Structural Information

Molecular Formula

C₈H₁₆O

SMILES

CCC1(CCCC1)CO

InChI

InChI=1S/C8H16O/c1-2-8(7-9)5-3-4-6-8/h9H,2-7H2,1H3

InChIKey

GLJSDRXLFVQXQU-UHFFFAOYSA-N

Compound name

(1-ethylcyclopentyl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 26
Patents: 128.12012 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]+	129.12740	129.5
[M+Na]+	151.10934	138.9
[M+NH4]+	146.15394	140.0
[M+K]+	167.08328	132.8
[M-H]-	127.11284	130.6
[M+Na-2H]-	149.09479	135.2
[M]+	128.11957	131.1
[M]-	128.12067	131.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe