CID 62695

Trans-2-butene

Structural Information

Molecular Formula

C₄H₈

SMILES

C/C=C/C

InChI

InChI=1S/C4H8/c1-3-4-2/h3-4H,1-2H3/b4-3+

InChIKey

IAQRGUVFOMOMEM-ONEGZZNKSA-N

Compound name

(E)-but-2-ene

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 714
References: 155725
Patents: 56.0626 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]+	57.069876	107.3
[M+Na]+	79.051818	115.8
[M-H]-	55.055324	108.2
[M+NH4]+	74.096423	132.7
[M+K]+	95.025758	115.9
[M+H-H2O]+	39.059860	104.0
[M+HCOO]-	101.06080	132.1
[M+CH3COO]-	115.07645	159.7
[M+Na-2H]-	77.037266	115.9
[M]+	56.062051	107.2
[M]-	56.063149	107.2

Literature stripe

literature stripe

Patent stripe

patents stripe