CID 195472

Tmcpo

Structural Information

Molecular Formula

C₁₇H₃₂NO₂

SMILES

CCCCCCCC(=O)C1CC(N(C(C1)(C)C)[O])(C)C

InChI

InChI=1S/C17H32NO2/c1-6-7-8-9-10-11-15(19)14-12-16(2,3)18(20)17(4,5)13-14/h14H,6-13H2,1-5H3

InChIKey

NDRAQNICXOVMMG-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 282.24332 Da
Monoisotopic Mass: 4.2
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]+	283.25060	167.7
[M+Na]+	305.23254	173.3
[M-H]-	281.23604	169.2
[M+NH4]+	300.27714	187.0
[M+K]+	321.20648	171.9
[M+H-H2O]+	265.24058	162.6
[M+HCOO]-	327.24152	183.7
[M+CH3COO]-	341.25717	205.8
[M+Na-2H]-	303.21799	168.5
[M]+	282.24277	170.3
[M]-	282.24387	170.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.