CID 9860272

Dimethylpentadecylamine oxide

Structural Information

Molecular Formula

C₁₇H₃₇NO

SMILES

CCCCCCCCCCCCCCC[N+](C)(C)[O-]

InChI

InChI=1S/C17H37NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2,3)19/h4-17H2,1-3H3

InChIKey

DLPZOAYAGDEIHC-UHFFFAOYSA-N

Compound name

N,N-dimethylpentadecan-1-amine oxide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1697
Patents: 271.2875 Da
Monoisotopic Mass: 6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	272.294776	176.6
[M+Na]+	294.276718	179.2
[M-H]-	270.280224	175.2
[M+NH4]+	289.321323	193.2
[M+K]+	310.250658	172.1
[M+H-H2O]+	254.284760	175.5
[M+HCOO]-	316.285701	197.1
[M+CH3COO]-	330.301351	201.2
[M+Na-2H]-	292.262166	180.6
[M]+	271.28695142	180.2
[M]-	271.28804858	180.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe