CID 3024887

97416-77-8

Structural Information

Molecular Formula
C7H15NO4
SMILES
C1COC(N1)C(CO)(CO)CO
InChI
InChI=1S/C7H15NO4/c9-3-7(4-10,5-11)6-8-1-2-12-6/h6,8-11H,1-5H2
InChIKey
WLZNNRXZWUUMGD-UHFFFAOYSA-N
Compound name
2-(hydroxymethyl)-2-(1,3-oxazolidin-2-yl)propane-1,3-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.10011 Da
Monoisotopic Mass

-2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.107386 139.2
[M+Na]+ 200.089328 143.6
[M-H]- 176.092834 135.8
[M+NH4]+ 195.133933 155.2
[M+K]+ 216.063268 142.5
[M+H-H2O]+ 160.097370 134.1
[M+HCOO]- 222.098311 153.1
[M+CH3COO]- 236.113961 167.2
[M+Na-2H]- 198.074776 144.0
[M]+ 177.09956142 135.0
[M]- 177.10065858 135.0
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.