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(3AR,6AS)-PERHYDROCYCLOPENTA-[D]-OXAZOL-2-ONE
SpectraBase Compound ID AeeNgMw5mL5
InChI InChI=1S/C6H9NO2/c8-6-7-4-2-1-3-5(4)9-6/h4-5H,1-3H2,(H,7,8)/t4-,5+/m1/s1
InChIKey BYBIMGJXEDBVDP-UHNVWZDZSA-N
Mol Weight 127.14 g/mol
Molecular Formula C6H9NO2
Exact Mass 127.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYGyL8bksDE
Name (3aR,6aS)-cis-Perhydroxycyclopenta[d]oxazol-2-one
Alternate Name(s) (3aR,6aS)-3,3a,4,5,6,6a-hexahydrocyclopenta[d][1,3]oxazol-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C6H9NO2
InChI InChI=1S/C6H9NO2/c8-6-7-4-2-1-3-5(4)9-6/h4-5H,1-3H2,(H,7,8)/t4-,5+/m1/s1
InChIKey BYBIMGJXEDBVDP-UHNVWZDZSA-N
Molecular Weight 127.143 g/mol
SMILES N1[C@@]2(CCC[C@@]2(OC1=O)[H])[H]
SPLASH splash10-004j-6900000000-39fede1ab92f0f0ba9b3
Source of Spectrum QC-10-482-8
Wiley ID 871059