CID 13580283

2-methylfuro[3,2-b]pyridine

Structural Information

Molecular Formula
C8H7NO
SMILES
CC1=CC2=C(O1)C=CC=N2
InChI
InChI=1S/C8H7NO/c1-6-5-7-8(10-6)3-2-4-9-7/h2-5H,1H3
InChIKey
OQZVRWIFADZMTL-UHFFFAOYSA-N
Compound name
2-methylfuro[3,2-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

92
Patents

133.05276 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.06004 120.8
[M+Na]+ 156.04198 132.3
[M-H]- 132.04548 125.7
[M+NH4]+ 151.08658 143.5
[M+K]+ 172.01592 131.2
[M+H-H2O]+ 116.05002 115.3
[M+HCOO]- 178.05096 146.0
[M+CH3COO]- 192.06661 136.9
[M+Na-2H]- 154.02743 131.4
[M]+ 133.05221 124.4
[M]- 133.05331 124.4
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