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]+ 218.138686 150.6
[M+Na]+ 240.120628 154.7
[M-H]- 216.124134 152.7
[M+NH4]+ 235.165233 162.0
[M+K]+ 256.094568 158.1
[M+H-H2O]+ 200.128670 140.0
[M+HCOO]- 262.129611 169.2
[M+CH3COO]- 276.145261 191.5
[M+Na-2H]- 238.106076 152.9
[M]+ 217.13086142 160.6
[M]- 217.13195858 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.