CID 113159

63225-53-6

Structural Information

Molecular Formula

C₁₀H₁₇NO₄

SMILES

CCCCNC(=O)OCCOC(=O)C=C

InChI

InChI=1S/C10H17NO4/c1-3-5-6-11-10(13)15-8-7-14-9(12)4-2/h4H,2-3,5-8H2,1H3,(H,11,13)

InChIKey

FLKHVLRENDBIDB-UHFFFAOYSA-N

Compound name

2-(butylcarbamoyloxy)ethyl prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 1093
Patents: 215.11575 Da
Monoisotopic Mass: 1.7
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]+	216.12303	150.3
[M+Na]+	238.10497	157.3
[M+NH4]+	233.14957	155.1
[M+K]+	254.07891	153.3
[M-H]-	214.10847	147.6
[M+Na-2H]-	236.09042	151.1
[M]+	215.11520	149.9
[M]-	215.11630	149.9

Literature stripe

literature stripe

Patent stripe

patents stripe