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METHYL-7,7,8,8-TETRAMETHYL5-OXO-TRANS-2-AZABICYCLO-[4.2.0]-OCTAN-2-CARBOXYLAT
SpectraBase Compound ID GbMaTg5FaPZ
InChI InChI=1S/C13H21NO3/c1-12(2)9-8(15)6-7-14(11(16)17-5)10(9)13(12,3)4/h9-10H,6-7H2,1-5H3/t9-,10-/m1/s1
InChIKey PKJVPFUKJLMYOR-NXEZZACHSA-N
Mol Weight 239.31 g/mol
Molecular Formula C13H21NO3
Exact Mass 239.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4EFNVNoC6S
Name Methyl-7,7,8,8-tetramethyl-5-oxo-trans-2-azabicyclo[4.2.0]octan-2-carboxylate
Alternate Name(s) Methyl (1R,6S)-7,7,8,8-tetramethyl-5-oxo-2-azabicyclo[4.2.0]octane-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO3
InChI InChI=1S/C13H21NO3/c1-12(2)9-8(15)6-7-14(11(16)17-5)10(9)13(12,3)4/h9-10H,6-7H2,1-5H3/t9-,10-/m1/s1
InChIKey PKJVPFUKJLMYOR-NXEZZACHSA-N
Literature Reference DOI 10.1002/hlca.19910740118
Molecular Weight 239.315 g/mol
SMILES C1CN(C(OC)=O)[C@@]2([C@@](C1=O)(C(C)(C)C2(C)C)[H])[H]
SPLASH splash10-0a59-9510000000-aedc617a003b7c5c42fd
Source of Spectrum H-74-175-13a
Wiley ID 1789155