CID 535295

3-(prop-2-en-1-yloxy)pyridine

Structural Information

Molecular Formula
C8H9NO
SMILES
C=CCOC1=CN=CC=C1
InChI
InChI=1S/C8H9NO/c1-2-6-10-8-4-3-5-9-7-8/h2-5,7H,1,6H2
InChIKey
KUWSQDFSFCOXTF-UHFFFAOYSA-N
Compound name
3-prop-2-enoxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

135.06842 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.075696 125.4
[M+Na]+ 158.057638 133.6
[M-H]- 134.061144 127.6
[M+NH4]+ 153.102243 145.9
[M+K]+ 174.031578 131.8
[M+H-H2O]+ 118.065680 119.1
[M+HCOO]- 180.066621 149.5
[M+CH3COO]- 194.082271 172.1
[M+Na-2H]- 156.043086 134.4
[M]+ 135.06787142 126.2
[M]- 135.06896858 126.2
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