CID 192830

6722-09-4

Structural Information

Molecular Formula
C12H9NO2
SMILES
C1=CC=C2C(=C1)C(C3=C(O2)N=CC=C3)O
InChI
InChI=1S/C12H9NO2/c14-11-8-4-1-2-6-10(8)15-12-9(11)5-3-7-13-12/h1-7,11,14H
InChIKey
CAOGEKWDLGLKQK-UHFFFAOYSA-N
Compound name
5H-chromeno[2,3-b]pyridin-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

199.06332 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.07060 138.5
[M+Na]+ 222.05254 148.0
[M-H]- 198.05604 142.2
[M+NH4]+ 217.09714 156.7
[M+K]+ 238.02648 145.1
[M+H-H2O]+ 182.06058 131.4
[M+HCOO]- 244.06152 157.1
[M+CH3COO]- 258.07717 151.7
[M+Na-2H]- 220.03799 149.5
[M]+ 199.06277 138.5
[M]- 199.06387 138.5
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