CID 19093458

1,3-dibromo-5-(dimethoxymethyl)benzene

Structural Information

Molecular Formula
C9H10Br2O2
SMILES
COC(C1=CC(=CC(=C1)Br)Br)OC
InChI
InChI=1S/C9H10Br2O2/c1-12-9(13-2)6-3-7(10)5-8(11)4-6/h3-5,9H,1-2H3
InChIKey
QONDTXWLYJSIIB-UHFFFAOYSA-N
Compound name
1,3-dibromo-5-(dimethoxymethyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

307.90475 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.91203 148.7
[M+Na]+ 330.89397 144.0
[M+NH4]+ 325.93857 150.7
[M+K]+ 346.86791 150.4
[M-H]- 306.89747 149.4
[M+Na-2H]- 328.87942 150.3
[M]+ 307.90420 147.1
[M]- 307.90530 147.1
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