CID 7298

Cyclopentanol

Structural Information

Molecular Formula

C₅H₁₀O

SMILES

C1CCC(C1)O

InChI

InChI=1S/C5H10O/c6-5-3-1-2-4-5/h5-6H,1-4H2

InChIKey

XCIXKGXIYUWCLL-UHFFFAOYSA-N

Compound name

cyclopentanol

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 111
References: 84179
Patents: 86.073166 Da
Monoisotopic Mass: 0.8
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]+	87.080442	116.3
[M+Na]+	109.06238	122.7
[M-H]-	85.065890	118.2
[M+NH4]+	104.10699	140.9
[M+K]+	125.03632	122.2
[M+H-H2O]+	69.070426	111.9
[M+HCOO]-	131.07137	138.6
[M+CH3COO]-	145.08702	159.5
[M+Na-2H]-	107.04783	121.8
[M]+	86.072617	112.0
[M]-	86.073715	112.0

Literature stripe

literature stripe

Patent stripe

patents stripe