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(trans)-3-[p-Nitrophenyl]-2,5-dimethyl-tetrahydropyrrolo[3,4-d]isoxazol-4,6-dione
SpectraBase Compound ID 6pINKUidY61
InChI InChI=1S/C13H13N3O5/c1-14-12(17)9-10(15(2)21-11(9)13(14)18)7-3-5-8(6-4-7)16(19)20/h3-6,9-11H,1-2H3
InChIKey BEXSPPFYRXKOEF-UHFFFAOYSA-N
Mol Weight 291.26 g/mol
Molecular Formula C13H13N3O5
Exact Mass 291.085521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GuV9BvJ96cX
Name (trans)-3-[p-Nitrophenyl]-2,5-dimethyl-tetrahydropyrrolo[3,4-d]isoxazol-4,6-dione
Alternate Name(s) (cis)-3-[p-Nitrophenyl]-2,5-dimethyl-tetrahydropyrrolo[3,4-d]isoxazol-4,6-dione 2,5-dimethyl-3-(4-nitrophenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione
Comments Less than 3 mono-isotopic peaks
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Formula C13H13N3O5
InChI InChI=1S/C13H13N3O5/c1-14-12(17)9-10(15(2)21-11(9)13(14)18)7-3-5-8(6-4-7)16(19)20/h3-6,9-11H,1-2H3
InChIKey BEXSPPFYRXKOEF-UHFFFAOYSA-N
Molecular Weight 291.263 g/mol
SMILES C12C(C(=O)N(C2=O)C)C(c2ccc(N(=O)=O)cc2)N(O1)C
SPLASH splash10-004l-0960000000-06beddf358a5e31d15bb
Source of Spectrum AJ-41-746-0
Wiley ID 1567648