CID 556332

1,1-dichloro-2-prop-1-enylcyclopropane

Structural Information

Molecular Formula
C6H8Cl2
SMILES
CC=CC1CC1(Cl)Cl
InChI
InChI=1S/C6H8Cl2/c1-2-3-5-4-6(5,7)8/h2-3,5H,4H2,1H3
InChIKey
OHVDETLOPFRCQO-UHFFFAOYSA-N
Compound name
1,1-dichloro-2-prop-1-enylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

150.0003 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.007576 123.5
[M+Na]+ 172.989518 134.8
[M-H]- 148.993024 127.7
[M+NH4]+ 168.034123 143.1
[M+K]+ 188.963458 130.6
[M+H-H2O]+ 132.997560 120.9
[M+HCOO]- 194.998501 138.1
[M+CH3COO]- 209.014151 177.3
[M+Na-2H]- 170.974966 130.4
[M]+ 149.99975142 127.9
[M]- 150.00084858 127.9
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