CID 15102884

104818-90-8

Structural Information

Molecular Formula
C7H7NO
SMILES
C=COC1=CN=CC=C1
InChI
InChI=1S/C7H7NO/c1-2-9-7-4-3-5-8-6-7/h2-6H,1H2
InChIKey
XVLCUTZHQANEAO-UHFFFAOYSA-N
Compound name
3-ethenoxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

121.052765 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.06004 120.7
[M+Na]+ 144.04198 129.3
[M-H]- 120.04549 123.2
[M+NH4]+ 139.08659 141.8
[M+K]+ 160.01592 127.9
[M+H-H2O]+ 104.05002 114.6
[M+HCOO]- 166.05097 145.2
[M+CH3COO]- 180.06662 169.1
[M+Na-2H]- 142.02743 130.3
[M]+ 121.05222 121.2
[M]- 121.05331 121.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe