CID 5463022

(z)-2-chloro-2-butene

Structural Information

Molecular Formula
C4H7Cl
SMILES
C/C=C(/C)\Cl
InChI
InChI=1S/C4H7Cl/c1-3-4(2)5/h3H,1-2H3/b4-3-
InChIKey
DSDHFHLZEFQSFM-ARJAWSKDSA-N
Compound name
(Z)-2-chlorobut-2-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

361
Patents

90.02363 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 91.030906 113.5
[M+Na]+ 113.01285 126.1
[M+NH4]+ 108.05745 123.2
[M+K]+ 128.98679 119.5
[M-H]- 89.016354 114.0
[M+Na-2H]- 110.99830 119.1
[M]+ 90.023081 115.7
[M]- 90.024179 115.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe