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trans-3,5-Dioxo-2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline
SpectraBase Compound ID ACtjdLOPE1j
InChI InChI=1S/C10H15NO2/c1-11-6-7-3-2-4-9(12)8(7)5-10(11)13/h7-8H,2-6H2,1H3/t7-,8-/m1/s1
InChIKey KCWWIDRMJVYJPM-HTQZYQBOSA-N
Mol Weight 181.23 g/mol
Molecular Formula C10H15NO2
Exact Mass 181.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KrlGGIITJlj
Name trans-3,5-Dioxo-2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline
Alternate Name(s) (4aR,8aS)-2-Methyl-octahydro-isoquinoline-3,5-dione (4aR,8aS)-2-methyloctahydro-3,5-isoquinolinedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO2
InChI InChI=1S/C10H15NO2/c1-11-6-7-3-2-4-9(12)8(7)5-10(11)13/h7-8H,2-6H2,1H3/t7-,8-/m1/s1
InChIKey KCWWIDRMJVYJPM-HTQZYQBOSA-N
Molecular Weight 181.235 g/mol
SMILES C1(N(C[C@@]2([C@@](C1)(C(=O)CCC2)[H])[H])C)=O
SPLASH splash10-001i-1900000000-ef5247edfcd57aea953f
Source of Spectrum F-52-8215-6
Wiley ID 796927