CID 165898863

Rac-tert-butyl n-[(1r,2r,4s)-2,4-dihydroxycyclopentyl]carbamate

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.13141 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.138686 149.8
[M+Na]+ 240.120628 155.0
[M-H]- 216.124134 150.5
[M+NH4]+ 235.165233 168.7
[M+K]+ 256.094568 154.1
[M+H-H2O]+ 200.128670 145.2
[M+HCOO]- 262.129611 168.2
[M+CH3COO]- 276.145261 184.0
[M+Na-2H]- 238.106076 151.2
[M]+ 217.13086142 147.7
[M]- 217.13195858 147.7
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.