CID 21117029

N-[3-(dimethylamino)propyl]dodecanamide n-oxide

Structural Information

Molecular Formula
C17H35N2O2
SMILES
CCCCCCCCCCCC(=O)N(CCCN(C)C)[O-]
InChI
InChI=1S/C17H35N2O2/c1-4-5-6-7-8-9-10-11-12-14-17(20)19(21)16-13-15-18(2)3/h4-16H2,1-3H3/q-1
InChIKey
DCDUPHNCDRUWFW-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-N-oxidododecanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

21
Patents

299.26987 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.277146 183.9
[M+Na]+ 322.259088 184.9
[M-H]- 298.262594 183.3
[M+NH4]+ 317.303693 199.1
[M+K]+ 338.233028 185.3
[M+H-H2O]+ 282.267130 178.3
[M+HCOO]- 344.268071 206.1
[M+CH3COO]- 358.283721 217.1
[M+Na-2H]- 320.244536 181.6
[M]+ 299.26932142 189.3
[M]- 299.27041858 189.3
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.