CID 6429123

2-(1-pyrrolidinyl)-2-cyclopenten-1-one

Structural Information

Molecular Formula
C9H13NO
SMILES
C1CCN(C1)C2=CCCC2=O
InChI
InChI=1S/C9H13NO/c11-9-5-3-4-8(9)10-6-1-2-7-10/h4H,1-3,5-7H2
InChIKey
ZWFIWLWLIXMBEA-UHFFFAOYSA-N
Compound name
2-pyrrolidin-1-ylcyclopent-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

151.09972 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.10700 134.3
[M+Na]+ 174.08894 144.2
[M+NH4]+ 169.13354 143.3
[M+K]+ 190.06288 141.6
[M-H]- 150.09244 136.6
[M+Na-2H]- 172.07439 139.5
[M]+ 151.09917 136.1
[M]- 151.10027 136.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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