CID 77654

4-bromo-n-[2-(dimethylamino)phenyl]-3,5-dihydroxybenzamide

Structural Information

Molecular Formula
C15H15BrN2O3
SMILES
CN(C)C1=CC=CC=C1NC(=O)C2=CC(=C(C(=C2)O)Br)O
InChI
InChI=1S/C15H15BrN2O3/c1-18(2)11-6-4-3-5-10(11)17-15(21)9-7-12(19)14(16)13(20)8-9/h3-8,19-20H,1-2H3,(H,17,21)
InChIKey
NUGUFUGDAQIDLH-UHFFFAOYSA-N
Compound name
4-bromo-N-[2-(dimethylamino)phenyl]-3,5-dihydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.0266 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.03388 171.1
[M+Na]+ 373.01582 180.3
[M-H]- 349.01932 179.1
[M+NH4]+ 368.06042 186.6
[M+K]+ 388.98976 168.8
[M+H-H2O]+ 333.02386 168.4
[M+HCOO]- 395.02480 191.4
[M+CH3COO]- 409.04045 212.4
[M+Na-2H]- 371.00127 174.2
[M]+ 350.02605 189.2
[M]- 350.02715 189.2
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