CID 117272748

1788874-18-9

Structural Information

Molecular Formula

SMILES

C1CCN2CCCC2(C1)CO

InChI

InChI=1S/C9H17NO/c11-8-9-4-1-2-6-10(9)7-3-5-9/h11H,1-8H2

InChIKey

USIZGVKOXLXUNM-UHFFFAOYSA-N

Compound name

2,3,5,6,7,8-hexahydro-1H-indolizin-8a-ylmethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 155.13101 Da
Monoisotopic Mass: 0.8
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	136.3
[M+Na]+	178.120228	141.5
[M-H]-	154.123734	136.9
[M+NH4]+	173.164833	159.7
[M+K]+	194.094168	139.4
[M+H-H2O]+	138.128270	130.6
[M+HCOO]-	200.129211	153.1
[M+CH3COO]-	214.144861	171.8
[M+Na-2H]-	176.105676	141.5
[M]+	155.13046142	130.2
[M]-	155.13155858	130.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe