CID 5189203

N,n-dimethylheptan-1-amine oxide

Structural Information

Molecular Formula
C9H21NO
SMILES
CCCCCCC[N+](C)(C)[O-]
InChI
InChI=1S/C9H21NO/c1-4-5-6-7-8-9-10(2,3)11/h4-9H2,1-3H3
InChIKey
SOVWKKYLBJMOPM-UHFFFAOYSA-N
Compound name
N,N-dimethylheptan-1-amine oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

65
Patents

159.16231 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.16959 136.8
[M+Na]+ 182.15153 148.2
[M+NH4]+ 177.19613 145.6
[M+K]+ 198.12547 143.7
[M-H]- 158.15503 138.4
[M+Na-2H]- 180.13698 141.1
[M]+ 159.16176 138.9
[M]- 159.16286 138.9
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

patents stripe