CID 137838524

6-methoxy-5-(oxan-4-yl)-2,3,4,5-tetrahydropyridine

Structural Information

Molecular Formula
C11H19NO2
SMILES
COC1=NCCCC1C2CCOCC2
InChI
InChI=1S/C11H19NO2/c1-13-11-10(3-2-6-12-11)9-4-7-14-8-5-9/h9-10H,2-8H2,1H3
InChIKey
YJTSAFTXQVHGLL-UHFFFAOYSA-N
Compound name
6-methoxy-5-(oxan-4-yl)-2,3,4,5-tetrahydropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.14159 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 145.5
[M+Na]+ 220.13081 149.2
[M-H]- 196.13431 150.0
[M+NH4]+ 215.17541 161.7
[M+K]+ 236.10475 149.1
[M+H-H2O]+ 180.13885 137.6
[M+HCOO]- 242.13979 161.9
[M+CH3COO]- 256.15544 181.9
[M+Na-2H]- 218.11626 150.2
[M]+ 197.14104 140.6
[M]- 197.14214 140.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.