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Spiro[cyclopentane-1,2'(1'H)-quinoxaline], 3'-(4-morpholinyl)-6',8'-dinitro-
SpectraBase Compound ID FfKFvRrhr9A
InChI InChI=1S/C16H19N5O5/c22-20(23)11-9-12-14(13(10-11)21(24)25)18-16(3-1-2-4-16)15(17-12)19-5-7-26-8-6-19/h9-10,18H,1-8H2
InChIKey MHFHCBHQMURIAI-UHFFFAOYSA-N
Mol Weight 361.36 g/mol
Molecular Formula C16H19N5O5
Exact Mass 361.138619 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BfPbqa7ugod
Name Spiro[cyclopentane-1,2'(1'H)-quinoxaline], 3'-(4-morpholinyl)-6',8'-dinitro-
Comments Computed using HOSE algorithm
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Exact Mass 361.138618727 u
Formula C16H19N5O5
InChI InChI=1S/C16H19N5O5/c22-20(23)11-9-12-14(13(10-11)21(24)25)18-16(3-1-2-4-16)15(17-12)19-5-7-26-8-6-19/h9-10,18H,1-8H2
InChIKey MHFHCBHQMURIAI-UHFFFAOYSA-N
Molecular Weight 361.358 g/mol
SMILES C=1(C=2NC3(CCCC3)C(=NC2C=C(N(=O)=O)C1)N1CCOCC1)N(=O)=O