CID 62740

2,4-dibromophenyl glycidyl ether

Structural Information

Molecular Formula
C9H8Br2O2
SMILES
C1C(O1)COC2=C(C=C(C=C2)Br)Br
InChI
InChI=1S/C9H8Br2O2/c10-6-1-2-9(8(11)3-6)13-5-7-4-12-7/h1-3,7H,4-5H2
InChIKey
NFWLWLQSZIJYFR-UHFFFAOYSA-N
Compound name
2-[(2,4-dibromophenoxy)methyl]oxirane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

152
Patents

305.8891 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.89638 146.7
[M+Na]+ 328.87832 159.4
[M-H]- 304.88182 157.2
[M+NH4]+ 323.92292 161.3
[M+K]+ 344.85226 145.5
[M+H-H2O]+ 288.88636 153.8
[M+HCOO]- 350.88730 163.3
[M+CH3COO]- 364.90295 205.8
[M+Na-2H]- 326.86377 154.6
[M]+ 305.88855 183.1
[M]- 305.88965 183.1
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

patents stripe