CID 63893689

1-(2,6-dichlorophenyl)-2-methylpropan-1-ol

Structural Information

Molecular Formula
C10H12Cl2O
SMILES
CC(C)C(C1=C(C=CC=C1Cl)Cl)O
InChI
InChI=1S/C10H12Cl2O/c1-6(2)10(13)9-7(11)4-3-5-8(9)12/h3-6,10,13H,1-2H3
InChIKey
UCJBRPKLZHWHEM-UHFFFAOYSA-N
Compound name
1-(2,6-dichlorophenyl)-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.02652 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.03380 143.4
[M+Na]+ 241.01574 157.6
[M+NH4]+ 236.06034 152.6
[M+K]+ 256.98968 150.5
[M-H]- 217.01924 145.3
[M+Na-2H]- 239.00119 149.8
[M]+ 218.02597 146.6
[M]- 218.02707 146.6
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

No patent data available for this compound.