CID 155884437

Alpha-pcyp

Structural Information

Molecular Formula
C18H25NO
SMILES
C1CCC(CC1)C(C(=O)C2=CC=CC=C2)N3CCCC3
InChI
InChI=1S/C18H25NO/c20-18(16-11-5-2-6-12-16)17(19-13-7-8-14-19)15-9-3-1-4-10-15/h2,5-6,11-12,15,17H,1,3-4,7-10,13-14H2
InChIKey
FKEHRWJWTWDTDB-UHFFFAOYSA-N
Compound name
2-cyclohexyl-1-phenyl-2-pyrrolidin-1-ylethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

271.1936 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.20088 167.8
[M+Na]+ 294.18282 168.3
[M-H]- 270.18632 173.8
[M+NH4]+ 289.22742 182.9
[M+K]+ 310.15676 164.7
[M+H-H2O]+ 254.19086 158.5
[M+HCOO]- 316.19180 182.8
[M+CH3COO]- 330.20745 176.6
[M+Na-2H]- 292.16827 165.8
[M]+ 271.19305 159.1
[M]- 271.19415 159.1
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.