CID 202615

1h-indeno(2,1-b)pyridine, 1-methyl-

Structural Information

Molecular Formula
C13H11N
SMILES
CN1C=CC=C2C1=CC3=CC=CC=C32
InChI
InChI=1S/C13H11N/c1-14-8-4-7-12-11-6-3-2-5-10(11)9-13(12)14/h2-9H,1H3
InChIKey
PKANWYWGBFEEOC-UHFFFAOYSA-N
Compound name
1-methylindeno[2,1-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.08914 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.096416 136.3
[M+Na]+ 204.078358 147.9
[M-H]- 180.081864 141.4
[M+NH4]+ 199.122963 159.5
[M+K]+ 220.052298 143.1
[M+H-H2O]+ 164.086400 129.9
[M+HCOO]- 226.087341 160.3
[M+CH3COO]- 240.102991 151.2
[M+Na-2H]- 202.063806 145.5
[M]+ 181.08859142 138.7
[M]- 181.08968858 138.7
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.