CID 6433886

Cinnamohydroxamic acid, 3-bromo-4-butoxy-

Structural Information

Molecular Formula
C13H16BrNO3
SMILES
CCCCOC1=C(C=C(C=C1)/C=C/C(=O)NO)Br
InChI
InChI=1S/C13H16BrNO3/c1-2-3-8-18-12-6-4-10(9-11(12)14)5-7-13(16)15-17/h4-7,9,17H,2-3,8H2,1H3,(H,15,16)/b7-5+
InChIKey
FSDNIHUUBAWDFE-FNORWQNLSA-N
Compound name
(E)-3-(3-bromo-4-butoxyphenyl)-N-hydroxyprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.03137 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.038646 163.2
[M+Na]+ 336.020588 172.4
[M-H]- 312.024094 167.6
[M+NH4]+ 331.065193 180.7
[M+K]+ 351.994528 160.1
[M+H-H2O]+ 296.028630 161.7
[M+HCOO]- 358.029571 183.2
[M+CH3COO]- 372.045221 201.2
[M+Na-2H]- 334.006036 167.2
[M]+ 313.03082142 182.9
[M]- 313.03191858 182.9
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.