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2-DEACETYL-SECOSPATACETAL-B

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2-DEACETYL-SECOSPATACETAL-B
SpectraBase Compound ID 5wb4CgpieFH
InChI InChI=1S/C22H36O5/c1-12(2)8-7-9-13(3)15-10-16(23)19-18(15)20-14(4)17(24)11-22(20,26-6)27-21(19)25-5/h8-9,14-21,23-24H,7,10-11H2,1-6H3/b13-9+/t14-,15+,16-,17+,18-,19-,20+,21-,22+/m1/s1
InChIKey SPJKKUMJWNUGKG-MERWLXQXSA-N
Mol Weight 380.5 g/mol
Molecular Formula C22H36O5
Exact Mass 380.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GPGOOMz7Z6F
Name 2-DEACETYL-SECOSPATACETAL-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36O5
InChI InChI=1S/C22H36O5/c1-12(2)8-7-9-13(3)15-10-16(23)19-18(15)20-14(4)17(24)11-22(20,26-6)27-21(19)25-5/h8-9,14-21,23-24H,7,10-11H2,1-6H3/b13-9+/t14-,15+,16-,17+,18-,19-,20+,21-,22+/m1/s1
InChIKey SPJKKUMJWNUGKG-MERWLXQXSA-N
Literature Reference Author H.YAMASE,K.UMEMOTO,T.OOI,T.KUSUMI
Literature Reference Citation CHEM.PHARM.BULL.,47,813(1999)
Literature Reference DOI 10.1248/cpb.47.813
Molecular Weight 380.525 g/mol
Solvent C6D6
Source File Reference UWLU8052