CID 70153647

1-oxa-8-azaspiro[4.6]undecane hydrochloride

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]+	156.138286	132.4
[M+Na]+	178.120228	134.5
[M-H]-	154.123734	135.5
[M+NH4]+	173.164833	151.6
[M+K]+	194.094168	136.0
[M+H-H2O]+	138.128270	125.8
[M+HCOO]-	200.129211	147.6
[M+CH3COO]-	214.144861	143.1
[M+Na-2H]-	176.105676	137.5
[M]+	155.13046142	121.5
[M]-	155.13155858	121.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe