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

145
Patents

216.1474 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.15468 151.7
[M+Na]+ 239.13662 155.3
[M-H]- 215.14012 150.4
[M+NH4]+ 234.18122 167.2
[M+K]+ 255.11056 153.9
[M+H-H2O]+ 199.14466 145.7
[M+HCOO]- 261.14560 166.5
[M+CH3COO]- 275.16125 183.6
[M+Na-2H]- 237.12207 154.6
[M]+ 216.14685 146.3
[M]- 216.14795 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