CID 9588346

2-butylcyclohexanone o-(3-(dimethylamino)-2-methylpropyl)oxime (e)-2-butenedioate (1:1)

Structural Information

Molecular Formula
C16H32N2O
SMILES
CCCCC\1CCCC/C1=N\OCC(C)CN(C)C
InChI
InChI=1S/C16H32N2O/c1-5-6-9-15-10-7-8-11-16(15)17-19-13-14(2)12-18(3)4/h14-15H,5-13H2,1-4H3/b17-16+
InChIKey
HOPVIDARLDVMDI-WUKNDPDISA-N
Compound name
3-[(E)-(2-butylcyclohexylidene)amino]oxy-N,N,2-trimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.25146 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.25874 170.2
[M+Na]+ 291.24068 177.8
[M+NH4]+ 286.28528 177.7
[M+K]+ 307.21462 171.0
[M-H]- 267.24418 173.2
[M+Na-2H]- 289.22613 173.5
[M]+ 268.25091 171.8
[M]- 268.25201 171.8
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.