CID 117538

2-methyl-6,7-dihydro-5h-cyclopenta[b]pyridine

Structural Information

Molecular Formula
C9H11N
SMILES
CC1=NC2=C(CCC2)C=C1
InChI
InChI=1S/C9H11N/c1-7-5-6-8-3-2-4-9(8)10-7/h5-6H,2-4H2,1H3
InChIKey
HOAJAZVXWNQMOV-UHFFFAOYSA-N
Compound name
2-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

133.08914 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.096416 125.9
[M+Na]+ 156.078358 134.7
[M-H]- 132.081864 129.2
[M+NH4]+ 151.122963 149.6
[M+K]+ 172.052298 132.3
[M+H-H2O]+ 116.086400 120.0
[M+HCOO]- 178.087341 148.5
[M+CH3COO]- 192.102991 140.4
[M+Na-2H]- 154.063806 133.0
[M]+ 133.08859142 124.8
[M]- 133.08968858 124.8
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