CID 91647688

(1r,2r)-2-ethoxycyclopentan-1-ol

Structural Information

Molecular Formula

C₇H₁₄O₂

SMILES

CCO[C@@H]1CCC[C@H]1O

InChI

InChI=1S/C7H14O2/c1-2-9-7-5-3-4-6(7)8/h6-8H,2-5H2,1H3/t6-,7-/m1/s1

InChIKey

CLFRTEKMZDRKMW-RNFRBKRXSA-N

Compound name

(1R,2R)-2-ethoxycyclopentan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 130.09938 Da
Monoisotopic Mass: 0.7
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]+	131.10666	127.4
[M+Na]+	153.08860	136.8
[M+NH4]+	148.13320	136.1
[M+K]+	169.06254	133.3
[M-H]-	129.09210	128.1
[M+Na-2H]-	151.07405	131.2
[M]+	130.09883	128.7
[M]-	130.09993	128.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe