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exo-7a-Bromomethyl-2-methyloctahydro-8-oxa-2,7b-diazadicyclopenta[a,e]pentalene-1,3-dione
SpectraBase Compound ID 2IZEaI73ktb
InChI InChI=1S/C14H19BrN2O3/c1-16-12(18)10-9-6-8-4-2-3-5-14(8,7-15)17(9)20-11(10)13(16)19/h8-11H,2-7H2,1H3/t8-,9+,10+,11-,14+/m1/s1
InChIKey KZPHIOZCBHZJDG-SLVJWFQDSA-N
Mol Weight 343.22 g/mol
Molecular Formula C14H19BrN2O3
Exact Mass 342.057905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYaVYdrWR7
Name exo-7a-Bromomethyl-2-methyloctahydro-8-oxa-2,7b-diazadicyclopenta[a,e]pentalene-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19BrN2O3
InChI InChI=1S/C14H19BrN2O3/c1-16-12(18)10-9-6-8-4-2-3-5-14(8,7-15)17(9)20-11(10)13(16)19/h8-11H,2-7H2,1H3/t8-,9+,10+,11-,14+/m1/s1
InChIKey KZPHIOZCBHZJDG-SLVJWFQDSA-N
Molecular Weight 343.221 g/mol
SMILES [C@@]12(N(O[C@]3(C(N(C([C@@]23[H])=O)C)=O)[H])[C@]2([C@@](C1)(CCCC2)[H])CBr)[H]
SPLASH splash10-0002-4290000000-ba8a05393440064dea1c
Source of Spectrum KC-57-7044-16
Synonyms (3aR,5aR,9aR,10aS,10bS)-5a-(bromomethyl)-2-methyldecahydro-1H-pyrrolo[3',4':4,5]isoxazolo[2,3-a]indole-1,3(2H)-dione
Wiley ID 1625341