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(+)-8-OXO-BETA-ERYTHROIDINE
SpectraBase Compound ID DxpgGKiLCXR
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/h2-3,6,12H,4-5,7-9H2,1H3/t12-,16-/m0/s1
InChIKey CVLPRJMKSSUYQJ-LRDDRELGSA-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 96WVSklpgHc
Name 8-Oxo-.beta.-erythroidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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/h2-3,6,12H,4-5,7-9H2,1H3/t12-,16-/m0/s1
InChIKey CVLPRJMKSSUYQJ-LRDDRELGSA-N
Molecular Weight 287.315 g/mol
SMILES [C@@]123N(C(=O)C=C3C=C[C@@](C1)(OC)[H])CCC1=C2CC(OC1)=O
SPLASH splash10-000i-0090000000-0ce3d22dd035058e0368
Source of Spectrum KC-1982-2907-0
Synonyms (4bS,6R)-6-methoxy-1,4,5,6,12,13-hexahydro-3H,10H-pyrano[4',3':3,4]pyrido[2,1-i]indole-3,10-dione
Wiley ID 1290803