CID 73555410

Neodecanamide, n-[2-(2-hydroxyethoxy)ethyl]-

Structural Information

Molecular Formula
C14H29NO3
SMILES
CCC(C(C)C)C(CC)C(=O)NCCOCCO
InChI
InChI=1S/C14H29NO3/c1-5-12(11(3)4)13(6-2)14(17)15-7-9-18-10-8-16/h11-13,16H,5-10H2,1-4H3,(H,15,17)
InChIKey
GNEIQKMHZNTNBR-UHFFFAOYSA-N
Compound name
2,3-diethyl-N-[2-(2-hydroxyethoxy)ethyl]-4-methylpentanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

259.21475 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.22203 169.7
[M+Na]+ 282.20397 171.7
[M-H]- 258.20747 167.3
[M+NH4]+ 277.24857 185.4
[M+K]+ 298.17791 171.2
[M+H-H2O]+ 242.21201 163.4
[M+HCOO]- 304.21295 187.3
[M+CH3COO]- 318.22860 201.3
[M+Na-2H]- 280.18942 167.1
[M]+ 259.21420 172.2
[M]- 259.21530 172.2
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.