CID 28875429

869293-80-1

Structural Information

Molecular Formula
C11H16N2O2
SMILES
C1COCCC1OC2=NC=CC(=C2)CN
InChI
InChI=1S/C11H16N2O2/c12-8-9-1-4-13-11(7-9)15-10-2-5-14-6-3-10/h1,4,7,10H,2-3,5-6,8,12H2
InChIKey
HQJIPLPCDHLOFW-UHFFFAOYSA-N
Compound name
[2-(oxan-4-yloxy)-4-pyridinyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

208.12119 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.128466 146.2
[M+Na]+ 231.110408 151.1
[M-H]- 207.113914 150.8
[M+NH4]+ 226.155013 161.3
[M+K]+ 247.084348 149.9
[M+H-H2O]+ 191.118450 137.8
[M+HCOO]- 253.119391 165.9
[M+CH3COO]- 267.135041 186.1
[M+Na-2H]- 229.095856 152.3
[M]+ 208.12064142 142.6
[M]- 208.12173858 142.6
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

patents stripe