CID 217230

38338-84-0

Structural Information

Molecular Formula
C11H16Br2N2O
SMILES
CCN(C)CC(C1=CC(=C(C(=C1)Br)N)Br)O
InChI
InChI=1S/C11H16Br2N2O/c1-3-15(2)6-10(16)7-4-8(12)11(14)9(13)5-7/h4-5,10,16H,3,6,14H2,1-2H3
InChIKey
ANSBUPIEUXMCNH-UHFFFAOYSA-N
Compound name
1-(4-amino-3,5-dibromophenyl)-2-[ethyl(methyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

349.96295 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.97023 159.4
[M+Na]+ 372.95217 167.9
[M-H]- 348.95567 165.2
[M+NH4]+ 367.99677 175.9
[M+K]+ 388.92611 151.5
[M+H-H2O]+ 332.96021 164.4
[M+HCOO]- 394.96115 174.3
[M+CH3COO]- 408.97680 216.9
[M+Na-2H]- 370.93762 161.9
[M]+ 349.96240 191.9
[M]- 349.96350 191.9
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

patents stripe