CID 70106

Cyclopentanecarbaldehyde

Structural Information

Molecular Formula

C₆H₁₀O

SMILES

C1CCC(C1)C=O

InChI

InChI=1S/C6H10O/c7-5-6-3-1-2-4-6/h5-6H,1-4H2

InChIKey

VELDYOPRLMJFIK-UHFFFAOYSA-N

Compound name

cyclopentanecarbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 10448
Patents: 98.073166 Da
Monoisotopic Mass: 1.3
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	119.8
[M+Na]+	121.06238	130.1
[M+NH4]+	116.10699	129.3
[M+K]+	137.03632	125.7
[M-H]-	97.065890	121.3
[M+Na-2H]-	119.04783	125.0
[M]+	98.072617	121.5
[M]-	98.073715	121.5

Literature stripe

literature stripe

Patent stripe

patents stripe