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3a',8b'-Dihydroxy-3'-(4-pyrimidinyl)-3a',8b'-dihydrospiro[indane-2,2'(3'H),4'H-indeno[1,2-b]furan]-1,3,4'-trione
SpectraBase Compound ID J8gVVjQt6SU
InChI InChI=1S/C23H14N2O6/c26-18-12-5-1-2-6-13(12)19(27)21(18)17(16-9-10-24-11-25-16)22(29)20(28)14-7-3-4-8-15(14)23(22,30)31-21/h1-11,17,29-30H/t17-,22+,23+/m0/s1
InChIKey QRNMVZGNFVKQFB-JJEOQYAHSA-N
Mol Weight 414.37 g/mol
Molecular Formula C23H14N2O6
Exact Mass 414.085186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HEGEZnCO2j2
Name 3a',8b'-Dihydroxy-3'-(4-pyrimidinyl)-3a',8b'-dihydrospiro[indane-2,2'(3'H),4'H-indeno[1,2-b]furan]-1,3,4'-trione
Alternate Name(s) (3'R,3'aR,8'bR)-3'a,8'b-dihydroxy-3'-(pyrimidin-4-yl)-3',3'a,4',8'b,1,3-hexahydrospiro[indene-2,2'-indeno[1,2-b]furan]-1,3,4'-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H14N2O6
InChI InChI=1S/C23H14N2O6/c26-18-12-5-1-2-6-13(12)19(27)21(18)17(16-9-10-24-11-25-16)22(29)20(28)14-7-3-4-8-15(14)23(22,30)31-21/h1-11,17,29-30H/t17-,22+,23+/m0/s1
InChIKey QRNMVZGNFVKQFB-JJEOQYAHSA-N
Molecular Weight 414.373 g/mol
SMILES O[C@]12[C@@]([C@](C3(O2)C(c2ccccc2C3=O)=O)(c2ncncc2)[H])(C(c2ccccc12)=O)O
SPLASH splash10-0ufr-3290000000-c1125ba6f502b855d7e4
Source of Spectrum H1-43-1675-7
Wiley ID 757849