CID 6393503

627-15-6

Structural Information

Molecular Formula
C3H4Br2
SMILES
C(/C=C/Br)Br
InChI
InChI=1S/C3H4Br2/c4-2-1-3-5/h1-2H,3H2/b2-1+
InChIKey
JWQMKMSVOYQICF-OWOJBTEDSA-N
Compound name
(E)-1,3-dibromoprop-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

228
Patents

197.86798 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.875256 119.4
[M+Na]+ 220.857198 131.1
[M-H]- 196.860704 124.0
[M+NH4]+ 215.901803 141.9
[M+K]+ 236.831138 116.0
[M+H-H2O]+ 180.865240 128.4
[M+HCOO]- 242.866181 136.5
[M+CH3COO]- 256.881831 189.0
[M+Na-2H]- 218.842646 128.9
[M]+ 197.86743142 152.5
[M]- 197.86852858 152.5
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

patents stripe