CID 10485

2-bromo-2-methylpropane

Structural Information

Molecular Formula
C4H9Br
SMILES
CC(C)(C)Br
InChI
InChI=1S/C4H9Br/c1-4(2,3)5/h1-3H3
InChIKey
RKSOPLXZQNSWAS-UHFFFAOYSA-N
Compound name
2-bromo-2-methylpropane
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

4
References

8643
Patents

135.98875 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.996026 121.1
[M+Na]+ 158.977968 133.2
[M-H]- 134.981474 124.9
[M+NH4]+ 154.022573 146.7
[M+K]+ 174.951908 124.1
[M+H-H2O]+ 118.986010 123.2
[M+HCOO]- 180.986951 141.6
[M+CH3COO]- 195.002601 173.0
[M+Na-2H]- 156.963416 130.8
[M]+ 135.98820142 139.5
[M]- 135.98929858 139.5
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