CID 70153647

2253640-71-8

Structural Information

Molecular Formula

SMILES

C1CC2(CCCO2)CCNC1

InChI

InChI=1S/C9H17NO/c1-3-9(4-2-8-11-9)5-7-10-6-1/h10H,1-8H2

InChIKey

LKODXJQTMSYTAY-UHFFFAOYSA-N

Compound name

1-oxa-9-azaspiro[4.6]undecane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 155.13101 Da
Monoisotopic Mass: 0.9
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]+	156.13829	132.4
[M+Na]+	178.12023	134.5
[M-H]-	154.12373	135.5
[M+NH4]+	173.16483	151.6
[M+K]+	194.09417	136.0
[M+H-H2O]+	138.12827	125.8
[M+HCOO]-	200.12921	147.6
[M+CH3COO]-	214.14486	143.1
[M+Na-2H]-	176.10568	137.5
[M]+	155.13046	121.5
[M]-	155.13156	121.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe