CID 124584467

1931995-22-0

Structural Information

Molecular Formula
C7H11NO3
SMILES
C[C@@H]1C[C@@H](NC(=O)C1)C(=O)O
InChI
InChI=1S/C7H11NO3/c1-4-2-5(7(10)11)8-6(9)3-4/h4-5H,2-3H2,1H3,(H,8,9)(H,10,11)/t4-,5-/m1/s1
InChIKey
OZWUPGBEUVJVEN-RFZPGFLSSA-N
Compound name
(2R,4R)-4-methyl-6-oxopiperidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.0739 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.08118 132.2
[M+Na]+ 180.06312 138.7
[M-H]- 156.06662 131.6
[M+NH4]+ 175.10772 150.4
[M+K]+ 196.03706 136.8
[M+H-H2O]+ 140.07116 126.9
[M+HCOO]- 202.07210 148.8
[M+CH3COO]- 216.08775 171.4
[M+Na-2H]- 178.04857 134.9
[M]+ 157.07335 127.0
[M]- 157.07445 127.0
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.

Patent stripe

No patent data available for this compound.