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MUSACIN-F
SpectraBase Compound ID 1Oz5k4vwc8g
InChI InChI=1S/C8H12O4/c1-2-3-5(9)8-6(10)4-7(11)12-8/h2-3,5-6,8-10H,4H2,1H3/b3-2+/t5-,6?,8?/m0/s1
InChIKey SCZBXCWCQZXSMJ-LKMIHNPOSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F0eDSROQfd1
Name MUSACIN-F
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c1-2-3-5(9)8-6(10)4-7(11)12-8/h2-3,5-6,8-10H,4H2,1H3/b3-2+/t5-,6?,8?/m0/s1
InChIKey SCZBXCWCQZXSMJ-LKMIHNPOSA-N
Literature Reference Author A.SCHNEIDER,J.SPAETH,S.BREIDING-MACK,A.ZEECK,S.GRABLEY,R.THI ERICKE
Literature Reference Citation J.ANTIBIOTICS,49,438(1996)
Literature Reference DOI 10.7164/antibiotics.49.438
Molecular Weight 172.181 g/mol
Solvent CDCl3
Source File Reference UWGE1935