CID 9815589

119692-59-0

Structural Information

Molecular Formula

C₁₀H₁₆O₄

SMILES

C=CC(=O)OCCCCOCC1CO1

InChI

InChI=1S/C10H16O4/c1-2-10(11)13-6-4-3-5-12-7-9-8-14-9/h2,9H,1,3-8H2

InChIKey

USWANRSZMQLWTG-UHFFFAOYSA-N

Compound name

4-(oxiran-2-ylmethoxy)butyl prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 1801
Patents: 200.10486 Da
Monoisotopic Mass: 1.0
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]+	201.11214	144.9
[M+Na]+	223.09408	155.6
[M+NH4]+	218.13868	151.7
[M+K]+	239.06802	152.3
[M-H]-	199.09758	152.3
[M+Na-2H]-	221.07953	150.1
[M]+	200.10431	149.3
[M]-	200.10541	149.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe