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Ethyl (3S,4S)-3-Nitromethyl-4,5-O-isopropylidenepentanoate
SpectraBase Compound ID J1MUeZP52MN
InChI InChI=1S/C11H19NO6/c1-4-16-10(13)5-8(6-12(14)15)9-7-17-11(2,3)18-9/h8-9H,4-7H2,1-3H3/t8-,9+/m0/s1
InChIKey AUDIVQVJJMELHM-DTWKUNHWSA-N
Mol Weight 261.27 g/mol
Molecular Formula C11H19NO6
Exact Mass 261.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4WaWZ4yAvvY
Name Ethyl (3S,4S)-3-Nitromethyl-4,5-O-isopropylidenepentanoate
Alternate Name(s) (3S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-nitrobutanoic acid ethyl ester Ethyl (3S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-nitrobutanoate Ethyl (3S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-nitro-butanoate
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Formula C11H19NO6
InChI InChI=1S/C11H19NO6/c1-4-16-10(13)5-8(6-12(14)15)9-7-17-11(2,3)18-9/h8-9H,4-7H2,1-3H3/t8-,9+/m0/s1
InChIKey AUDIVQVJJMELHM-DTWKUNHWSA-N
Molecular Weight 261.274 g/mol
SMILES C(N(=O)=O)[C@@]([C@@]1(OC(C)(C)OC1)[H])(CC(=O)OCC)[H]
SPLASH splash10-0fft-4950000000-4d7490ff99631bd4c00f
Source of Spectrum SO-0-475-3
Wiley ID 1544923