CID 16643565

[2-amino-2-(4-bromophenyl)ethyl]dimethylamine

Structural Information

Molecular Formula
C10H15BrN2
SMILES
CN(C)CC(C1=CC=C(C=C1)Br)N
InChI
InChI=1S/C10H15BrN2/c1-13(2)7-10(12)8-3-5-9(11)6-4-8/h3-6,10H,7,12H2,1-2H3
InChIKey
MGCUJCDYAGLWLF-UHFFFAOYSA-N
Compound name
1-(4-bromophenyl)-N',N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.04185 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.049126 148.9
[M+Na]+ 265.031068 157.9
[M-H]- 241.034574 155.6
[M+NH4]+ 260.075673 169.7
[M+K]+ 281.005008 147.4
[M+H-H2O]+ 225.039110 147.2
[M+HCOO]- 287.040051 171.1
[M+CH3COO]- 301.055701 198.3
[M+Na-2H]- 263.016516 154.0
[M]+ 242.04130142 165.9
[M]- 242.04239858 165.9
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

No patent data available for this compound.