CID 105846

1,2-epoxynonadecane

Structural Information

Molecular Formula

C₁₉H₃₈O

SMILES

CCCCCCCCCCCCCCCCCC1CO1

InChI

InChI=1S/C19H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-18-20-19/h19H,2-18H2,1H3

InChIKey

CEUXMUYHMURJFZ-UHFFFAOYSA-N

Compound name

2-heptadecyloxirane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 527
Patents: 282.29227 Da
Monoisotopic Mass: 9.0
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]+	283.29955	169.8
[M+Na]+	305.28149	180.3
[M+NH4]+	300.32609	177.5
[M+K]+	321.25543	173.3
[M-H]-	281.28499	178.8
[M+Na-2H]-	303.26694	175.0
[M]+	282.29172	174.9
[M]-	282.29282	174.9

Literature stripe

literature stripe

Patent stripe

patents stripe