CID 2245425

[2-(2-bromoethoxy)ethoxy]benzene

Structural Information

Molecular Formula
C10H13BrO2
SMILES
C1=CC=C(C=C1)OCCOCCBr
InChI
InChI=1S/C10H13BrO2/c11-6-7-12-8-9-13-10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKey
FETWVQRXLBDILP-UHFFFAOYSA-N
Compound name
2-(2-bromoethoxy)ethoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

244.00989 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.01717 145.8
[M+Na]+ 266.99911 155.8
[M-H]- 243.00261 151.5
[M+NH4]+ 262.04371 166.7
[M+K]+ 282.97305 145.7
[M+H-H2O]+ 227.00715 145.5
[M+HCOO]- 289.00809 167.9
[M+CH3COO]- 303.02374 188.6
[M+Na-2H]- 264.98456 154.2
[M]+ 244.00934 167.3
[M]- 244.01044 167.3
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.