CID 10489504

2-(2-bromophenyl)-2-methylpropan-1-amine

Structural Information

Molecular Formula
C10H14BrN
SMILES
CC(C)(CN)C1=CC=CC=C1Br
InChI
InChI=1S/C10H14BrN/c1-10(2,7-12)8-5-3-4-6-9(8)11/h3-6H,7,12H2,1-2H3
InChIKey
VKIIPNMFKYLRKM-UHFFFAOYSA-N
Compound name
2-(2-bromophenyl)-2-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

227.03096 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.038236 145.2
[M+Na]+ 250.020178 155.9
[M-H]- 226.023684 151.1
[M+NH4]+ 245.064783 166.7
[M+K]+ 265.994118 144.3
[M+H-H2O]+ 210.028220 145.3
[M+HCOO]- 272.029161 165.7
[M+CH3COO]- 286.044811 190.0
[M+Na-2H]- 248.005626 152.7
[M]+ 227.03041142 162.2
[M]- 227.03150858 162.2
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