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CHLOROHYDROASPYRONE_B

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CHLOROHYDROASPYRONE_B
SpectraBase Compound ID 8zciyYaJpph
InChI InChI=1S/C9H13ClO4/c1-4(10)8(12)6-3-7(11)5(2)14-9(6)13/h3-5,7-8,11-12H,1-2H3/t4-,5-,7+,8+/m1/s1
InChIKey RFRJSDLXLVSACH-KYNKHSRBSA-N
Mol Weight 220.65 g/mol
Molecular Formula C9H13ClO4
Exact Mass 220.050237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Sp2GUxum38
Name CHLOROHYDROASPYRONE_B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13ClO4
InChI InChI=1S/C9H13ClO4/c1-4(10)8(12)6-3-7(11)5(2)14-9(6)13/h3-5,7-8,11-12H,1-2H3/t4-,5-,7+,8+/m1/s1
InChIKey RFRJSDLXLVSACH-KYNKHSRBSA-N
Literature Reference Author D.ZHANG,X.YANG,J.S.KANG,H.D.CHOI,B.W.SON
Literature Reference Citation J.NAT.PROD.,71,1458(2008)
Literature Reference DOI 10.1021/np800107c
Molecular Weight 220.653 g/mol
Sample ID 28522
Solvent C6D6