CID 11721

2-methoxypropane

Structural Information

Molecular Formula

C₄H₁₀O

SMILES

CC(C)OC

InChI

InChI=1S/C4H10O/c1-4(2)5-3/h4H,1-3H3

InChIKey

RMGHERXMTMUMMV-UHFFFAOYSA-N

Compound name

2-methoxypropane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 40896
Patents: 74.073166 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]+	75.080442	112.5
[M+Na]+	97.062384	120.3
[M-H]-	73.065890	113.3
[M+NH4]+	92.106989	137.1
[M+K]+	113.03632	121.8
[M+H-H2O]+	57.070426	108.8
[M+HCOO]-	119.07137	136.2
[M+CH3COO]-	133.08702	164.1
[M+Na-2H]-	95.047832	119.6
[M]+	74.072617	113.8
[M]-	74.073715	113.8

Literature stripe

literature stripe

Patent stripe

patents stripe