CID 61823

Cetyl glycidyl ether

Structural Information

Molecular Formula

C₁₉H₃₈O₂

SMILES

CCCCCCCCCCCCCCCCOCC1CO1

InChI

InChI=1S/C19H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-17-19-18-21-19/h19H,2-18H2,1H3

InChIKey

YZUMRMCHAJVDRT-UHFFFAOYSA-N

Compound name

2-(hexadecoxymethyl)oxirane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 3152
Patents: 298.28717 Da
Monoisotopic Mass: 7.5
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]+	299.29445	173.2
[M+Na]+	321.27639	183.2
[M+NH4]+	316.32099	180.3
[M+K]+	337.25033	176.7
[M-H]-	297.27989	181.7
[M+Na-2H]-	319.26184	177.9
[M]+	298.28662	178.0
[M]-	298.28772	178.0

Literature stripe

literature stripe

Patent stripe

patents stripe