CID 736538

160706-62-7

Structural Information

Molecular Formula
C14H17NO4
SMILES
C1C[C@H](CN(C1)C(=O)OCC2=CC=CC=C2)C(=O)O
InChI
InChI=1S/C14H17NO4/c16-13(17)12-7-4-8-15(9-12)14(18)19-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,17)/t12-/m1/s1
InChIKey
FFLPIVZNYJKKDM-GFCCVEGCSA-N
Compound name
(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

167
Patents

263.11575 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.12303 160.3
[M+Na]+ 286.10497 170.5
[M+NH4]+ 281.14957 166.4
[M+K]+ 302.07891 165.7
[M-H]- 262.10847 161.5
[M+Na-2H]- 284.09042 165.3
[M]+ 263.11520 161.7
[M]- 263.11630 161.7
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

patents stripe