CID 86499

17026-88-9

Structural Information

Molecular Formula
C8H17NO2
SMILES
CCC1(N(CCO1)CCO)C
InChI
InChI=1S/C8H17NO2/c1-3-8(2)9(4-6-10)5-7-11-8/h10H,3-7H2,1-2H3
InChIKey
IBWDRPSBZYIJIU-UHFFFAOYSA-N
Compound name
2-(2-ethyl-2-methyl-1,3-oxazolidin-3-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

159.12593 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.133206 134.5
[M+Na]+ 182.115148 141.6
[M-H]- 158.118654 135.8
[M+NH4]+ 177.159753 156.1
[M+K]+ 198.089088 141.8
[M+H-H2O]+ 142.123190 129.7
[M+HCOO]- 204.124131 154.0
[M+CH3COO]- 218.139781 173.8
[M+Na-2H]- 180.100596 140.0
[M]+ 159.12538142 134.7
[M]- 159.12647858 134.7
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