CID 167734575

Rac-tert-butyln-[(1r,2r,3r)-3-hydroxy-2-methoxycyclobutyl]carbamate

Structural Information

Molecular Formula
C10H19NO4
SMILES
CC(C)(C)OC(=O)N[C@H]1C[C@@H]([C@H]1OC)O
InChI
InChI=1S/C10H19NO4/c1-10(2,3)15-9(13)11-6-5-7(12)8(6)14-4/h6-8,12H,5H2,1-4H3,(H,11,13)/t6-,7-,8-/m0/s1
InChIKey
OLRUCZTWUNPWRB-FXQIFTODSA-N
Compound name
tert-butyl N-[(1S,2S,3S)-3-hydroxy-2-methoxycyclobutyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.13141 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.13869 150.6
[M+Na]+ 240.12063 154.7
[M-H]- 216.12413 152.7
[M+NH4]+ 235.16523 162.0
[M+K]+ 256.09457 158.1
[M+H-H2O]+ 200.12867 140.0
[M+HCOO]- 262.12961 169.2
[M+CH3COO]- 276.14526 191.5
[M+Na-2H]- 238.10608 152.9
[M]+ 217.13086 160.6
[M]- 217.13196 160.6
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

No patent data available for this compound.