CID 118628362

1853339-29-3

Structural Information

Molecular Formula
C10H19NO4
SMILES
CC(C)(C)OC(=O)NC1C[C@H]([C@H](C1)O)O
InChI
InChI=1S/C10H19NO4/c1-10(2,3)15-9(14)11-6-4-7(12)8(13)5-6/h6-8,12-13H,4-5H2,1-3H3,(H,11,14)/t6?,7-,8+
InChIKey
OUKPLRJCZUQNRI-IEESLHIDSA-N
Compound name
tert-butyl N-[(3R,4S)-3,4-dihydroxycyclopentyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

217.13141 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.13869 149.8
[M+Na]+ 240.12063 155.0
[M-H]- 216.12413 150.5
[M+NH4]+ 235.16523 168.7
[M+K]+ 256.09457 154.1
[M+H-H2O]+ 200.12867 145.2
[M+HCOO]- 262.12961 168.2
[M+CH3COO]- 276.14526 184.0
[M+Na-2H]- 238.10608 151.2
[M]+ 217.13086 147.7
[M]- 217.13196 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

patents stripe