CID 1514122

Cyclopent-3-en-1-ylmethanol

Structural Information

Molecular Formula

C₆H₁₀O

SMILES

C1C=CCC1CO

InChI

InChI=1S/C6H10O/c7-5-6-3-1-2-4-6/h1-2,6-7H,3-5H2

InChIKey

ADLKZHGHNJBOOC-UHFFFAOYSA-N

Compound name

cyclopent-3-en-1-ylmethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 519
Patents: 98.073166 Da
Monoisotopic Mass: 1.0
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]+	99.080442	118.6
[M+Na]+	121.06238	125.7
[M-H]-	97.065890	120.8
[M+NH4]+	116.10699	142.9
[M+K]+	137.03632	124.7
[M+H-H2O]+	81.070426	114.1
[M+HCOO]-	143.07137	142.1
[M+CH3COO]-	157.08702	162.1
[M+Na-2H]-	119.04783	124.6
[M]+	98.072617	116.2
[M]-	98.073715	116.2

Literature stripe

literature stripe

Patent stripe

patents stripe