CID 199823

3-(p-chlorophenyl)-5-(3-cyclohexenyl)-3-pyrrolidinol hydrochloride

Structural Information

Molecular Formula
C16H20ClNO
SMILES
C1CC(CC=C1)C2CC(CN2)(C3=CC=C(C=C3)Cl)O
InChI
InChI=1S/C16H20ClNO/c17-14-8-6-13(7-9-14)16(19)10-15(18-11-16)12-4-2-1-3-5-12/h1-2,6-9,12,15,18-19H,3-5,10-11H2
InChIKey
GZJJHASAHVLXDM-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-5-cyclohex-3-en-1-ylpyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
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References

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Patents

277.12335 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.13063 165.0
[M+Na]+ 300.11257 177.8
[M+NH4]+ 295.15717 175.7
[M+K]+ 316.08651 169.4
[M-H]- 276.11607 170.0
[M+Na-2H]- 298.09802 173.9
[M]+ 277.12280 168.6
[M]- 277.12390 168.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.