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8-Oxo-A-erythroidine
SpectraBase Compound ID CU99hBNG4r5
InChI InChI=1S/C16H17NO4/c1-20-12-3-2-11-6-14(18)17-5-4-10-9-21-15(19)7-13(10)16(11,17)8-12/h2-3,6-7,10,12H,4-5,8-9H2,1H3/t10-,12+,16+/m1/s1
InChIKey NMFUSYUBPJMLRH-XAGWURHQSA-N
Mol Weight 287.31 g/mol
Molecular Formula C16H17NO4
Exact Mass 287.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CwmzLH4S04q
Name 8-Oxo-.alpha.-erythroidine
Alternate Name(s) (4bS,6R,13aS)-6-methoxy-1,5,6,12,13,13a-hexahydro-3H,10H-pyrano[4',3':3,4]pyrido[2,1-i]indole-3,10-dione
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Formula C16H17NO4
InChI InChI=1S/C16H17NO4/c1-20-12-3-2-11-6-14(18)17-5-4-10-9-21-15(19)7-13(10)16(11,17)8-12/h2-3,6-7,10,12H,4-5,8-9H2,1H3/t10-,12+,16+/m1/s1
InChIKey NMFUSYUBPJMLRH-XAGWURHQSA-N
Molecular Weight 287.315 g/mol
SMILES [C@@]123N(C(=O)C=C3C=C[C@@](C1)(OC)[H])CC[C@]1(C2=CC(=O)OC1)[H]
SPLASH splash10-000i-0090000000-4a85a29c47ac3f4128b5
Source of Spectrum KC-1982-2907-0
Wiley ID 1290802