CID 11160118

43213-61-2

Structural Information

Molecular Formula
C11H11NO
SMILES
C1CNCC2=C1OC3=CC=CC=C23
InChI
InChI=1S/C11H11NO/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-4,12H,5-7H2
InChIKey
OGOWMVYFFWEWQT-UHFFFAOYSA-N
Compound name
1,2,3,4-tetrahydro-[1]benzofuro[3,2-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

104
Patents

173.08406 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.09134 132.4
[M+Na]+ 196.07328 141.5
[M-H]- 172.07678 135.9
[M+NH4]+ 191.11788 153.4
[M+K]+ 212.04722 138.2
[M+H-H2O]+ 156.08132 126.4
[M+HCOO]- 218.08226 151.9
[M+CH3COO]- 232.09791 146.0
[M+Na-2H]- 194.05873 141.6
[M]+ 173.08351 131.0
[M]- 173.08461 131.0
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