CID 138987667

Octahydro-2h-pyrano[2,3-c]pyridin-4-ol

Structural Information

Molecular Formula

C₈H₁₅NO₂

SMILES

C1CNCC2C1C(CCO2)O

InChI

InChI=1S/C8H15NO2/c10-7-2-4-11-8-5-9-3-1-6(7)8/h6-10H,1-5H2

InChIKey

XLIDEWMUYNOCGL-UHFFFAOYSA-N

Compound name

3,4,4a,5,6,7,8,8a-octahydro-2H-pyrano[2,3-c]pyridin-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 157.11028 Da
Monoisotopic Mass: -0.4
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]+	158.117556	133.6
[M+Na]+	180.099498	137.8
[M-H]-	156.103004	133.4
[M+NH4]+	175.144103	151.3
[M+K]+	196.073438	136.5
[M+H-H2O]+	140.107540	127.5
[M+HCOO]-	202.108481	146.3
[M+CH3COO]-	216.124131	170.2
[M+Na-2H]-	178.084946	139.7
[M]+	157.10973142	125.5
[M]-	157.11082858	125.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe