CID 155973769

Rac-(2r,4s)-4-(dimethylphosphoryl)piperidine-2-carboxylic acid hydrochloride, cis

Structural Information

Molecular Formula
C8H16NO3P
SMILES
CP(=O)(C)[C@@H]1CCN[C@@H](C1)C(=O)O
InChI
InChI=1S/C8H16NO3P/c1-13(2,12)6-3-4-9-7(5-6)8(10)11/h6-7,9H,3-5H2,1-2H3,(H,10,11)/t6-,7+/m1/s1
InChIKey
NADAUDYYMYMPQM-RQJHMYQMSA-N
Compound name
(2S,4R)-4-dimethylphosphorylpiperidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.08678 Da
Monoisotopic Mass

-3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.09406 147.9
[M+Na]+ 228.07600 152.6
[M-H]- 204.07950 145.5
[M+NH4]+ 223.12060 164.5
[M+K]+ 244.04994 150.9
[M+H-H2O]+ 188.08404 140.2
[M+HCOO]- 250.08498 167.6
[M+CH3COO]- 264.10063 180.5
[M+Na-2H]- 226.06145 147.7
[M]+ 205.08623 143.4
[M]- 205.08733 143.4
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.