CID 18185989

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

Structural Information

Molecular Formula
C10H15NO
SMILES
CC1=C(C(=O)CC1)N2CCCC2
InChI
InChI=1S/C10H15NO/c1-8-4-5-9(12)10(8)11-6-2-3-7-11/h2-7H2,1H3
InChIKey
SXIDVHLMAKILQP-UHFFFAOYSA-N
Compound name
3-methyl-2-pyrrolidin-1-ylcyclopent-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1476
Patents

165.11537 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 138.1
[M+Na]+ 188.10459 148.2
[M+NH4]+ 183.14919 147.0
[M+K]+ 204.07853 145.6
[M-H]- 164.10809 140.5
[M+Na-2H]- 186.09004 142.9
[M]+ 165.11482 139.9
[M]- 165.11592 139.9
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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