CID 10727458

Tert-butyl (3r,4r)-4-amino-3-hydroxypiperidine-1-carboxylate

Structural Information

Molecular Formula
C10H20N2O3
SMILES
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](C1)O)N
InChI
InChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-5-4-7(11)8(13)6-12/h7-8,13H,4-6,11H2,1-3H3/t7-,8-/m1/s1
InChIKey
KREUZCYJWPQPJX-HTQZYQBOSA-N
Compound name
tert-butyl (3R,4R)-4-amino-3-hydroxypiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

391
Patents

216.1474 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.154676 151.3
[M+Na]+ 239.136618 156.4
[M-H]- 215.140124 151.3
[M+NH4]+ 234.181223 167.7
[M+K]+ 255.110558 155.5
[M+H-H2O]+ 199.144660 145.5
[M+HCOO]- 261.145601 167.1
[M+CH3COO]- 275.161251 186.7
[M+Na-2H]- 237.122066 153.1
[M]+ 216.14685142 147.2
[M]- 216.14794858 147.2
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