CID 61944

1,2-dibromopropyl glycidyl ether

Structural Information

Molecular Formula

C₆H₁₀Br₂O₂

SMILES

CC(C(OCC1CO1)Br)Br

InChI

InChI=1S/C6H10Br2O2/c1-4(7)6(8)10-3-5-2-9-5/h4-6H,2-3H2,1H3

InChIKey

HIUZIZLYVGKTHZ-UHFFFAOYSA-N

Compound name

2-(1,2-dibromopropoxymethyl)oxirane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 4
Patents: 271.90475 Da
Monoisotopic Mass: 1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	272.912026	144.2
[M+Na]+	294.893968	155.7
[M-H]-	270.897474	152.1
[M+NH4]+	289.938573	159.5
[M+K]+	310.867908	141.8
[M+H-H2O]+	254.902010	150.8
[M+HCOO]-	316.902951	158.7
[M+CH3COO]-	330.918601	202.3
[M+Na-2H]-	292.879416	150.6
[M]+	271.90420142	179.9
[M]-	271.90529858	179.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe