CID 6433956

Cinnamohydroxamic acid, 3-chloro-4-isopentoxy-

Structural Information

Molecular Formula
C14H18ClNO3
SMILES
CC(C)CCOC1=C(C=C(C=C1)/C=C/C(=O)NO)Cl
InChI
InChI=1S/C14H18ClNO3/c1-10(2)7-8-19-13-5-3-11(9-12(13)15)4-6-14(17)16-18/h3-6,9-10,18H,7-8H2,1-2H3,(H,16,17)/b6-4+
InChIKey
CVMNGQUKPNSVQJ-GQCTYLIASA-N
Compound name
(E)-3-[3-chloro-4-(3-methylbutoxy)phenyl]-N-hydroxyprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.09753 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.104806 164.4
[M+Na]+ 306.086748 171.1
[M-H]- 282.090254 166.4
[M+NH4]+ 301.131353 180.4
[M+K]+ 322.060688 166.5
[M+H-H2O]+ 266.094790 158.9
[M+HCOO]- 328.095731 181.4
[M+CH3COO]- 342.111381 199.6
[M+Na-2H]- 304.072196 165.4
[M]+ 283.09698142 167.9
[M]- 283.09807858 167.9
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.