CID 10703946

1787258-87-0

Structural Information

Molecular Formula
C10H20N2O3
SMILES
CC(C)(C)OC(=O)N[C@@H]1CCNC[C@@H]1O
InChI
InChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-7-4-5-11-6-8(7)13/h7-8,11,13H,4-6H2,1-3H3,(H,12,14)/t7-,8+/m1/s1
InChIKey
MLTCALYMVICSBJ-SFYZADRCSA-N
Compound name
tert-butyl N-[(3S,4R)-3-hydroxypiperidin-4-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

119
Patents

216.1474 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.154676 151.7
[M+Na]+ 239.136618 155.3
[M-H]- 215.140124 150.4
[M+NH4]+ 234.181223 167.2
[M+K]+ 255.110558 153.9
[M+H-H2O]+ 199.144660 145.7
[M+HCOO]- 261.145601 166.5
[M+CH3COO]- 275.161251 183.6
[M+Na-2H]- 237.122066 154.6
[M]+ 216.14685142 146.3
[M]- 216.14794858 146.3
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