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PANTOPYRANOID-B
SpectraBase Compound ID Gwa9uPzRdRR
InChI InChI=1S/C10H16BrClO3/c1-9(13,3-4-12)8-5-7(11)10(2,14)6-15-8/h3-4,7-8,13-14H,5-6H2,1-2H3/b4-3+/t7-,8+,9?,10-/m1/s1
InChIKey CXSUPLDYPUBCTI-NCFBLIIWSA-N
Mol Weight 299.59 g/mol
Molecular Formula C10H16BrClO3
Exact Mass 297.997135 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KKvTnrG9MCf
Name PANTOPYRANOID-B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H16BrClO3
InChI InChI=1S/C10H16BrClO3/c1-9(13,3-4-12)8-5-7(11)10(2,14)6-15-8/h3-4,7-8,13-14H,5-6H2,1-2H3/b4-3+/t7-,8+,9?,10-/m1/s1
InChIKey CXSUPLDYPUBCTI-NCFBLIIWSA-N
Literature Reference Author M.CUETO,J.DARIAS,J.ROVIROSA,A.SANMARTIN
Literature Reference Citation J.NAT.PROD.,61,17(1998)
Literature Reference DOI 10.1021/np9601162
Molecular Weight 299.592 g/mol
Solvent CDCl3
Source File Reference UWCP632