CID 209164

Styrene, 4-chloro-beta,beta-dimethyl-

Structural Information

Molecular Formula
C10H11Cl
SMILES
CC(=CC1=CC=C(C=C1)Cl)C
InChI
InChI=1S/C10H11Cl/c1-8(2)7-9-3-5-10(11)6-4-9/h3-7H,1-2H3
InChIKey
WRALWKVPQMAMTI-UHFFFAOYSA-N
Compound name
1-chloro-4-(2-methylprop-1-enyl)benzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

26
Patents

166.05493 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.06221 132.6
[M+Na]+ 189.04415 141.6
[M-H]- 165.04765 136.4
[M+NH4]+ 184.08875 154.5
[M+K]+ 205.01809 137.3
[M+H-H2O]+ 149.05219 128.4
[M+HCOO]- 211.05313 151.6
[M+CH3COO]- 225.06878 178.7
[M+Na-2H]- 187.02960 138.1
[M]+ 166.05438 133.9
[M]- 166.05548 133.9
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