CID 14220439

143955-12-8

Structural Information

Molecular Formula

C₇H₁₀O₃

SMILES

CC(=O)C1CC1C(=O)OC

InChI

InChI=1S/C7H10O3/c1-4(8)5-3-6(5)7(9)10-2/h5-6H,3H2,1-2H3

InChIKey

MSCQZOISCXMNDV-UHFFFAOYSA-N

Compound name

methyl 2-acetylcyclopropane-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 142.06299 Da
Monoisotopic Mass: -0.1
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]+	143.07027	128.3
[M+Na]+	165.05221	138.1
[M-H]-	141.05571	133.5
[M+NH4]+	160.09681	145.3
[M+K]+	181.02615	137.0
[M+H-H2O]+	125.06025	123.0
[M+HCOO]-	187.06119	151.2
[M+CH3COO]-	201.07684	178.5
[M+Na-2H]-	163.03766	132.4
[M]+	142.06244	133.1
[M]-	142.06354	133.1

Literature stripe

literature stripe

Patent stripe

patents stripe