CID 14651329

3-[4-(chloromethyl)phenoxy]oxolane

Structural Information

Molecular Formula
C11H13ClO2
SMILES
C1COCC1OC2=CC=C(C=C2)CCl
InChI
InChI=1S/C11H13ClO2/c12-7-9-1-3-10(4-2-9)14-11-5-6-13-8-11/h1-4,11H,5-8H2
InChIKey
FUUOAIKCEFOQRM-UHFFFAOYSA-N
Compound name
3-[4-(chloromethyl)phenoxy]oxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.06041 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.06769 143.5
[M+Na]+ 235.04963 156.9
[M+NH4]+ 230.09423 153.3
[M+K]+ 251.02357 151.2
[M-H]- 211.05313 148.8
[M+Na-2H]- 233.03508 150.8
[M]+ 212.05986 147.2
[M]- 212.06096 147.2
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.