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4 -(1 -Hydroxy-2 -nitroethyl) -3 -methyl-N2 -oxide-1,2,5 -oxadiazole
SpectraBase Compound ID J3d0NdDW3t1
InChI InChI=1S/C5H7N3O5/c1-3-5(6-13-8(3)12)4(9)2-7(10)11/h4,9H,2H2,1H3
InChIKey RIAFCGCRWIIECQ-UHFFFAOYSA-N
Mol Weight 189.13 g/mol
Molecular Formula C5H7N3O5
Exact Mass 189.03857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxGoYnSkEPw
Name 4 -(1 -Hydroxy-2 -nitroethyl) -3 -methyl-N2 -oxide-1,2,5 -oxadiazole
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Formula C5H7N3O5
InChI InChI=1S/C5H7N3O5/c1-3-5(6-13-8(3)12)4(9)2-7(10)11/h4,9H,2H2,1H3
InChIKey RIAFCGCRWIIECQ-UHFFFAOYSA-N
Molecular Weight 189.127 g/mol
SMILES OC(c1c([n+](on1)[O-])C)CN(=O)=O
SPLASH splash10-000i-0900000000-e95b4528f80147d884ec
Source of Spectrum EMC-36-778-14
Synonyms 4-(1-Hydroxy-2-nitroethyl)-3-methyl-N2-oxide-1,2,5-oxadiazole 4-(1-hydroxy-2-nitroethyl)-3-methyl-1,2,5-oxadiazole 2-oxide 1-(4-Methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)-2-nitroethanol 1-(4-Methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)-2-nitro-ethanol 1-(4-Methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-yl)-2-nitro-ethanol
Wiley ID 1735569