CID 44152604

188570-78-7

Structural Information

Molecular Formula

C₁₀H₁₆O₂

SMILES

CC/C=C\CCOC(=O)C1CC1

InChI

InChI=1S/C10H16O2/c1-2-3-4-5-8-12-10(11)9-6-7-9/h3-4,9H,2,5-8H2,1H3/b4-3-

InChIKey

AQALQDMWXUIMHX-ARJAWSKDSA-N

Compound name

[(Z)-hex-3-enyl] cyclopropanecarboxylate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 81
Patents: 168.11504 Da
Monoisotopic Mass: 2.3
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]+	169.12232	138.5
[M+Na]+	191.10426	149.7
[M+NH4]+	186.14886	146.5
[M+K]+	207.07820	145.2
[M-H]-	167.10776	145.5
[M+Na-2H]-	189.08971	145.0
[M]+	168.11449	142.9
[M]-	168.11559	142.9

Literature stripe

literature stripe

Patent stripe

patents stripe