CID 18185999

3,4-dimethyl-2-(1-pyrrolidinyl)-2-cyclopenten-1-one

Structural Information

Molecular Formula
C11H17NO
SMILES
CC1CC(=O)C(=C1C)N2CCCC2
InChI
InChI=1S/C11H17NO/c1-8-7-10(13)11(9(8)2)12-5-3-4-6-12/h8H,3-7H2,1-2H3
InChIKey
ASHYMNYOWDHCGV-UHFFFAOYSA-N
Compound name
3,4-dimethyl-2-pyrrolidin-1-ylcyclopent-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

179.13101 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.13829 142.0
[M+Na]+ 202.12023 152.2
[M+NH4]+ 197.16483 150.7
[M+K]+ 218.09417 149.7
[M-H]- 178.12373 144.4
[M+Na-2H]- 200.10568 146.3
[M]+ 179.13046 143.9
[M]- 179.13156 143.9
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