CID 53989396

Cyclobutane, 1,2-dichloro-1,2-divinyl-, trans-

Structural Information

Molecular Formula
C8H10Cl2
SMILES
C=C[C@@]1(CC[C@]1(C=C)Cl)Cl
InChI
InChI=1S/C8H10Cl2/c1-3-7(9)5-6-8(7,10)4-2/h3-4H,1-2,5-6H2/t7-,8-/m0/s1
InChIKey
KDUDIFZXLKGGSI-YUMQZZPRSA-N
Compound name
(1R,2R)-1,2-dichloro-1,2-bis(ethenyl)cyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

176.01596 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.02324 126.5
[M+Na]+ 199.00518 136.3
[M-H]- 175.00868 130.1
[M+NH4]+ 194.04978 145.9
[M+K]+ 214.97912 133.1
[M+H-H2O]+ 159.01322 121.9
[M+HCOO]- 221.01416 139.6
[M+CH3COO]- 235.02981 182.1
[M+Na-2H]- 196.99063 133.5
[M]+ 176.01541 136.3
[M]- 176.01651 136.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe