CID 3042204

6-(vinyloxy)quinoline

Structural Information

Molecular Formula
C11H9NO
SMILES
C=COC1=CC2=C(C=C1)N=CC=C2
InChI
InChI=1S/C11H9NO/c1-2-13-10-5-6-11-9(8-10)4-3-7-12-11/h2-8H,1H2
InChIKey
STBBGXCELOSTPW-UHFFFAOYSA-N
Compound name
6-ethenoxyquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.06842 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.07570 133.4
[M+Na]+ 194.05764 142.7
[M-H]- 170.06114 136.7
[M+NH4]+ 189.10224 153.6
[M+K]+ 210.03158 139.2
[M+H-H2O]+ 154.06568 126.6
[M+HCOO]- 216.06662 156.4
[M+CH3COO]- 230.08227 179.7
[M+Na-2H]- 192.04309 143.2
[M]+ 171.06787 134.4
[M]- 171.06897 134.4
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

No patent data available for this compound.