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Methyl 7-methyl-3-oxo-2-oxa-5-azabicyclo[2.2.2]octane-5-carboxylate
SpectraBase Compound ID 8hQKbu3tNMi
InChI InChI=1S/C9H13NO4/c1-5-3-6-8(11)14-7(5)4-10(6)9(12)13-2/h5-7H,3-4H2,1-2H3/t5-,6-,7+/m1/s1
InChIKey XSWUINJJHYQURY-QYNIQEEDSA-N
Mol Weight 199.21 g/mol
Molecular Formula C9H13NO4
Exact Mass 199.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FodmSVjDKxP
Name Methyl 7-methyl-3-oxo-2-oxa-5-azabicyclo[2.2.2]octane-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO4
InChI InChI=1S/C9H13NO4/c1-5-3-6-8(11)14-7(5)4-10(6)9(12)13-2/h5-7H,3-4H2,1-2H3/t5-,6-,7+/m1/s1
InChIKey XSWUINJJHYQURY-QYNIQEEDSA-N
Molecular Weight 199.206 g/mol
SMILES [C@]12(N(C[C@](OC2=O)([C@](C)(C1)[H])[H])C(=O)OC)[H]
SPLASH splash10-056u-1900000000-2143c14d66db82e5e5fb
Source of Spectrum QC-8-1120-11
Synonyms (1S,4S,7S)-Methyl 7-methyl-3-oxo-2-oxa-5-azabicyclo[2.2.2]octane-5-carboxylate
Wiley ID 869871