CID 7281

2,3-dibromo-1-propanol

Structural Information

Molecular Formula
C3H6Br2O
SMILES
C(C(CBr)Br)O
InChI
InChI=1S/C3H6Br2O/c4-1-3(5)2-6/h3,6H,1-2H2
InChIKey
QWVCIORZLNBIIC-UHFFFAOYSA-N
Compound name
2,3-dibromopropan-1-ol
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

27
References

3410
Patents

215.87854 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.88582 134.9
[M+Na]+ 238.86776 129.0
[M+NH4]+ 233.91236 136.9
[M+K]+ 254.84170 136.1
[M-H]- 214.87126 134.1
[M+Na-2H]- 236.85321 135.3
[M]+ 215.87799 132.6
[M]- 215.87909 132.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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