CID 86867

2-butene, 2,3-dibromo-

Structural Information

Molecular Formula
C4H6Br2
SMILES
CC(=C(C)Br)Br
InChI
InChI=1S/C4H6Br2/c1-3(5)4(2)6/h1-2H3
InChIKey
SDEHPRGMSHJNMU-UHFFFAOYSA-N
Compound name
2,3-dibromobut-2-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

560
Patents

211.88364 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.89092 126.2
[M+Na]+ 234.87286 137.2
[M-H]- 210.87636 130.7
[M+NH4]+ 229.91746 148.1
[M+K]+ 250.84680 122.3
[M+H-H2O]+ 194.88090 134.9
[M+HCOO]- 256.88184 141.4
[M+CH3COO]- 270.89749 192.5
[M+Na-2H]- 232.85831 133.0
[M]+ 211.88309 158.5
[M]- 211.88419 158.5
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