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3,3-bis(methoxycarbonyl)-N-phenyl-6,7-diazatricyclo[3.2.2.0(2,4)]none-8-ene-6,7-dicarboximide
SpectraBase Compound ID FPoIM8wSt4T
InChI InChI=1S/C19H17N3O6/c1-27-15(23)19(16(24)28-2)13-11-8-9-12(14(13)19)22-18(26)20(17(25)21(11)22)10-6-4-3-5-7-10/h3-9,11-14H,1-2H3/t11-,12-,13+,14+/m0/s1
InChIKey OMJHKJJTAPLOAZ-IGQOVBAYSA-N
Mol Weight 383.36 g/mol
Molecular Formula C19H17N3O6
Exact Mass 383.111735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UYD3nR7Smm
Name 3,3-bis(methoxycarbonyl)-N-phenyl-6,7-diazatricyclo[3.2.2.0(2,4)]none-8-ene-6,7-dicarboximide
Alternate Name(s) Dimethyl 3,5-dioxo-4-phenyl-2,4,6-triazatetracyclo[5.3.2.0(2,6).0(8,10)]dodec-11-ene-9,9-dicarboxylate
CAS Registry Number 109746-65-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17N3O6
InChI InChI=1S/C19H17N3O6/c1-27-15(23)19(16(24)28-2)13-11-8-9-12(14(13)19)22-18(26)20(17(25)21(11)22)10-6-4-3-5-7-10/h3-9,11-14H,1-2H3/t11-,12-,13+,14+/m0/s1
InChIKey OMJHKJJTAPLOAZ-IGQOVBAYSA-N
Molecular Weight 383.360 g/mol
SMILES C1([C@@]2([C@]3(N4C(=O)N(C(N4[C@]([C@@]12[H])(C=C3)[H])=O)c1ccccc1)[H])[H])(C(=O)OC)C(=O)OC
SPLASH splash10-002e-3900000000-a4833cd4d756f72f4cd1
Source of Spectrum K-120-2079-6
Wiley ID 1361026