CID 12274207

261-27-8

Structural Information

Molecular Formula
C12H9NO
SMILES
C1C2=C(N=CC=C2)OC3=CC=CC=C31
InChI
InChI=1S/C12H9NO/c1-2-6-11-9(4-1)8-10-5-3-7-13-12(10)14-11/h1-7H,8H2
InChIKey
MXIYRNSRKGMBLQ-UHFFFAOYSA-N
Compound name
5H-chromeno[2,3-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

79
Patents

183.06842 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.07570 136.3
[M+Na]+ 206.05764 153.0
[M+NH4]+ 201.10224 147.2
[M+K]+ 222.03158 144.4
[M-H]- 182.06114 142.0
[M+Na-2H]- 204.04309 144.9
[M]+ 183.06787 140.6
[M]- 183.06897 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

literature stripe

Patent stripe

patents stripe