CID 297

Methane

Structural Information

Molecular Formula

SMILES

C

InChI

InChI=1S/CH4/h1H4

InChIKey

VNWKTOKETHGBQD-UHFFFAOYSA-N

Compound name

methane

Related CIDs

2D Structure

compound 2d structure

10
Annotation Hits: 26139
References: 2702807
Patents: 16.0313 Da
Monoisotopic Mass: 0.6
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]+	17.038576	97.2
[M+Na]+	39.020518	105.6
[M-H]-	15.024024	97.9
[M+NH4]+	34.065123	123.8
[M+K]+	54.994458	107.0
[M+H-H2O]+	-0.971440	93.4
[M+HCOO]-	61.029501	123.0
[M+CH3COO]-	75.045151	151.5
[M+Na-2H]-	37.005966	107.9
[M]+	16.030751	96.8
[M]-	16.031849	96.8

Literature stripe

literature stripe

Patent stripe

patents stripe