CID 10857681

(2s)-1-[(tert-butoxy)carbonyl]-4-oxopiperidine-2-carboxylic acid

Structural Information

Molecular Formula
C11H17NO5
SMILES
CC(C)(C)OC(=O)N1CCC(=O)C[C@H]1C(=O)O
InChI
InChI=1S/C11H17NO5/c1-11(2,3)17-10(16)12-5-4-7(13)6-8(12)9(14)15/h8H,4-6H2,1-3H3,(H,14,15)/t8-/m0/s1
InChIKey
GPBCBXYUAJQMQM-QMMMGPOBSA-N
Compound name
(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxopiperidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

208
Patents

243.11067 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.11795 152.3
[M+Na]+ 266.09989 157.9
[M-H]- 242.10339 152.8
[M+NH4]+ 261.14449 167.8
[M+K]+ 282.07383 157.7
[M+H-H2O]+ 226.10793 146.7
[M+HCOO]- 288.10887 167.2
[M+CH3COO]- 302.12452 188.8
[M+Na-2H]- 264.08534 153.6
[M]+ 243.11012 151.3
[M]- 243.11122 151.3
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