CID 82078502

1-((1-chloro-2-methylpropan-2-yl)oxy)-4-methoxybenzene

Structural Information

Molecular Formula
C11H15ClO2
SMILES
CC(C)(CCl)OC1=CC=C(C=C1)OC
InChI
InChI=1S/C11H15ClO2/c1-11(2,8-12)14-10-6-4-9(13-3)5-7-10/h4-7H,8H2,1-3H3
InChIKey
PFAAIIMPPHSISG-UHFFFAOYSA-N
Compound name
1-(1-chloro-2-methylpropan-2-yl)oxy-4-methoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.07605 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.08333 145.3
[M+Na]+ 237.06527 158.8
[M+NH4]+ 232.10987 154.1
[M+K]+ 253.03921 151.9
[M-H]- 213.06877 147.1
[M+Na-2H]- 235.05072 152.5
[M]+ 214.07550 148.2
[M]- 214.07660 148.2
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.