CID 129369625

Rel-(3r,4r)-4-cyclohexylpyrrolidine-3-carboxylic acid

Structural Information

Molecular Formula
C11H19NO2
SMILES
C1CCC(CC1)[C@H]2CNC[C@@H]2C(=O)O
InChI
InChI=1S/C11H19NO2/c13-11(14)10-7-12-6-9(10)8-4-2-1-3-5-8/h8-10,12H,1-7H2,(H,13,14)/t9-,10+/m1/s1
InChIKey
OKFXFIAXJCYRML-ZJUUUORDSA-N
Compound name
(3R,4R)-4-cyclohexylpyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.14159 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 148.0
[M+Na]+ 220.13081 155.6
[M+NH4]+ 215.17541 155.4
[M+K]+ 236.10475 152.6
[M-H]- 196.13431 148.9
[M+Na-2H]- 218.11626 150.6
[M]+ 197.14104 148.8
[M]- 197.14214 148.8
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.