CID 11832131

1219002-13-7

Structural Information

Molecular Formula
C13H25NO4
SMILES
CC1(N([C@@H](CO1)CCCO)C(=O)OC(C)(C)C)C
InChI
InChI=1S/C13H25NO4/c1-12(2,3)18-11(16)14-10(7-6-8-15)9-17-13(14,4)5/h10,15H,6-9H2,1-5H3/t10-/m1/s1
InChIKey
JEPJZGUFARGBJH-SNVBAGLBSA-N
Compound name
tert-butyl (4R)-4-(3-hydroxypropyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

259.17834 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.18562 160.8
[M+Na]+ 282.16756 167.2
[M-H]- 258.17106 162.2
[M+NH4]+ 277.21216 178.8
[M+K]+ 298.14150 167.6
[M+H-H2O]+ 242.17560 156.6
[M+HCOO]- 304.17654 176.7
[M+CH3COO]- 318.19219 192.6
[M+Na-2H]- 280.15301 163.4
[M]+ 259.17779 164.2
[M]- 259.17889 164.2
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