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3a,4-trans-3a,9a-cis-4-(Nitromethyl)-2,3,3a,9a-tetrahydro-4H-furo[2,3-b]chromen-8-ol
SpectraBase Compound ID 6AxnLwvWuDp
InChI InChI=1S/C12H13NO5/c14-10-3-1-2-7-9(6-13(15)16)8-4-5-17-12(8)18-11(7)10/h1-3,8-9,12,14H,4-6H2/t8-,9+,12+/m1/s1
InChIKey VGXJPFCGRPPZBD-PTRXPTGYSA-N
Mol Weight 251.24 g/mol
Molecular Formula C12H13NO5
Exact Mass 251.079373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3FORjOH3oyZ
Name 3A,4-TRANS-3A,9A-CIS-4-(NITROMETHYL)-2,3,3A,9A-TETRAHYDRO-4H-FURO-[2.3-B]-CHROMEN-8-OL
Compound Number 19D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO5
InChI InChI=1S/C12H13NO5/c14-10-3-1-2-7-9(6-13(15)16)8-4-5-17-12(8)18-11(7)10/h1-3,8-9,12,14H,4-6H2/t8-,9+,12+/m1/s1
InChIKey VGXJPFCGRPPZBD-PTRXPTGYSA-N
Literature Reference Author D.AMANTINI,F.FRINGUELLI,F.PIZZO
Literature Reference Citation J.ORG.CHEM.,67,7238(2002)
Literature Reference DOI 10.1021/jo0260185
Molecular Weight 251.239 g/mol
Solvent ACETONE-D6
Source File Reference UWSI22214