CID 5864959

Sorbohydroxamic acid

Structural Information

Molecular Formula
C6H9NO2
SMILES
C/C=C/C=C/C(=O)NO
InChI
InChI=1S/C6H9NO2/c1-2-3-4-5-6(8)7-9/h2-5,9H,1H3,(H,7,8)/b3-2+,5-4+
InChIKey
AKPBWCUNVIPWOM-MQQKCMAXSA-N
Compound name
(2E,4E)-N-hydroxyhexa-2,4-dienamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

172
Patents

127.06333 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.07061 127.4
[M+Na]+ 150.05255 136.0
[M+NH4]+ 145.09715 133.8
[M+K]+ 166.02649 131.3
[M-H]- 126.05605 125.7
[M+Na-2H]- 148.03800 129.9
[M]+ 127.06278 127.6
[M]- 127.06388 127.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe