CID 6324

Ethane

Structural Information

Molecular Formula

C₂H₆

SMILES

CC

InChI

InChI=1S/C2H6/c1-2/h1-2H3

InChIKey

OTMSDBZUPAUEDD-UHFFFAOYSA-N

Compound name

ethane

Related CIDs

2D Structure

compound 2d structure

9
Annotation Hits: 2690
References: 615772
Patents: 30.04695 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]+	31.054226	99.2
[M+Na]+	53.036168	108.0
[M-H]-	29.039674	100.3
[M+NH4]+	48.080773	125.5
[M+K]+	69.010108	109.2
[M+H-H2O]+	13.044210	96.1
[M+HCOO]-	75.045151	124.3
[M+CH3COO]-	89.060801	156.0
[M+Na-2H]-	51.021616	108.8
[M]+	30.046401	99.1
[M]-	30.047499	99.1

Literature stripe

literature stripe

Patent stripe

patents stripe