CID 71755693

2-(pyrrolidin-2-yl)cyclohexan-1-one hydrochloride

Structural Information

Molecular Formula
C10H17NO
SMILES
C1CCC(=O)C(C1)C2CCCN2
InChI
InChI=1S/C10H17NO/c12-10-6-2-1-4-8(10)9-5-3-7-11-9/h8-9,11H,1-7H2
InChIKey
NHPRYPGSMPYAOM-UHFFFAOYSA-N
Compound name
2-pyrrolidin-2-ylcyclohexan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.13101 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.13829 140.5
[M+Na]+ 190.12023 149.7
[M+NH4]+ 185.16483 149.2
[M+K]+ 206.09417 145.3
[M-H]- 166.12373 142.7
[M+Na-2H]- 188.10568 144.8
[M]+ 167.13046 142.0
[M]- 167.13156 142.0
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.

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No patent data available for this compound.