CID 15812154

77570-31-1

Structural Information

Molecular Formula

C₈H₁₃NO₂

SMILES

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

InChI

InChI=1S/C8H13NO2/c1-2-11-8(10)5-7(9)6-3-4-6/h5-6H,2-4,9H2,1H3/b7-5-

InChIKey

SJAOFPHBAYOIAX-ALCCZGGFSA-N

Compound name

ethyl (Z)-3-amino-3-cyclopropylprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 155.09464 Da
Monoisotopic Mass: 1.1
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]+	156.10192	134.1
[M+Na]+	178.08386	143.9
[M+NH4]+	173.12846	141.7
[M+K]+	194.05780	141.3
[M-H]-	154.08736	141.1
[M+Na-2H]-	176.06931	140.0
[M]+	155.09409	138.2
[M]-	155.09519	138.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.