CID 6428979

6-ethyl-1,2,3,4,5,6-hexahydro-7h-cyclopenta[b]pyridin-7-one

Structural Information

Molecular Formula
C10H15NO
SMILES
CCC1CC2=C(C1=O)NCCC2
InChI
InChI=1S/C10H15NO/c1-2-7-6-8-4-3-5-11-9(8)10(7)12/h7,11H,2-6H2,1H3
InChIKey
GOTCNQZLHJWEAK-UHFFFAOYSA-N
Compound name
6-ethyl-1,2,3,4,5,6-hexahydrocyclopenta[b]pyridin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.11537 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 136.9
[M+Na]+ 188.10459 143.9
[M-H]- 164.10809 138.2
[M+NH4]+ 183.14919 158.6
[M+K]+ 204.07853 140.6
[M+H-H2O]+ 148.11263 131.3
[M+HCOO]- 210.11357 155.0
[M+CH3COO]- 224.12922 176.2
[M+Na-2H]- 186.09004 140.3
[M]+ 165.11482 132.5
[M]- 165.11592 132.5
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

No patent data available for this compound.