CID 41320

55090-44-3

Structural Information

Molecular Formula
C13H28N2O
SMILES
CCCCCCCCCCCCN(C)N=O
InChI
InChI=1S/C13H28N2O/c1-3-4-5-6-7-8-9-10-11-12-13-15(2)14-16/h3-13H2,1-2H3
InChIKey
QPUKANZXOGADOB-UHFFFAOYSA-N
Compound name
N-dodecyl-N-methylnitrous amide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

13
References

1049
Patents

228.22017 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.22745 160.2
[M+Na]+ 251.20939 163.6
[M-H]- 227.21289 161.9
[M+NH4]+ 246.25399 179.1
[M+K]+ 267.18333 163.6
[M+H-H2O]+ 211.21743 152.9
[M+HCOO]- 273.21837 186.1
[M+CH3COO]- 287.23402 205.4
[M+Na-2H]- 249.19484 163.6
[M]+ 228.21962 166.4
[M]- 228.22072 166.4
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.