CID 119907

1-(chloromethyl)-4-[4-(chloromethyl)phenoxy]benzene

Structural Information

Molecular Formula
C14H12Cl2O
SMILES
C1=CC(=CC=C1CCl)OC2=CC=C(C=C2)CCl
InChI
InChI=1S/C14H12Cl2O/c15-9-11-1-5-13(6-2-11)17-14-7-3-12(10-16)4-8-14/h1-8H,9-10H2
InChIKey
ONXYNIGRSCRZNU-UHFFFAOYSA-N
Compound name
1-(chloromethyl)-4-[4-(chloromethyl)phenoxy]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

150
Patents

266.02652 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.03380 156.0
[M+Na]+ 289.01574 173.6
[M+NH4]+ 284.06034 166.4
[M+K]+ 304.98968 163.1
[M-H]- 265.01924 161.5
[M+Na-2H]- 287.00119 166.7
[M]+ 266.02597 161.0
[M]- 266.02707 161.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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