CID 21924633

1-ethylcyclopropane-1-carbaldehyde

Structural Information

Molecular Formula

C₆H₁₀O

SMILES

CCC1(CC1)C=O

InChI

InChI=1S/C6H10O/c1-2-6(5-7)3-4-6/h5H,2-4H2,1H3

InChIKey

QNAJNOKTSIAJIL-UHFFFAOYSA-N

Compound name

1-ethylcyclopropane-1-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 77
Patents: 98.073166 Da
Monoisotopic Mass: 0.9
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	121.2
[M+Na]+	121.06238	134.1
[M+NH4]+	116.10699	132.2
[M+K]+	137.03632	127.8
[M-H]-	97.065890	129.6
[M+Na-2H]-	119.04783	131.1
[M]+	98.072617	126.7
[M]-	98.073715	126.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe