CID 135528439

N-cyclododecyl-2-(hydroxyimino)-3-oxobutanamide

Structural Information

Molecular Formula
C16H28N2O3
SMILES
C/C(=C(/C(=O)NC1CCCCCCCCCCC1)\N=O)/O
InChI
InChI=1S/C16H28N2O3/c1-13(19)15(18-21)16(20)17-14-11-9-7-5-3-2-4-6-8-10-12-14/h14,19H,2-12H2,1H3,(H,17,20)/b15-13+
InChIKey
PPEYFAHOODEECP-FYWRMAATSA-N
Compound name
(E)-N-cyclododecyl-3-hydroxy-2-nitrosobut-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.21 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.217276 171.8
[M+Na]+ 319.199218 170.4
[M-H]- 295.202724 171.0
[M+NH4]+ 314.243823 182.6
[M+K]+ 335.173158 170.1
[M+H-H2O]+ 279.207260 167.6
[M+HCOO]- 341.208201 187.2
[M+CH3COO]- 355.223851 200.5
[M+Na-2H]- 317.184666 169.1
[M]+ 296.20945142 160.3
[M]- 296.21054858 160.3
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.