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XDYVGSLAZSCWPJ-ZBHHGKBUSA-N
SpectraBase Compound ID GT9vF1MbjJh
InChI InChI=1S/C22H30O3S/c1-14(2)16-12-13-22(3)18(26-15-8-6-5-7-9-15)11-10-17(21(24)25-4)19(22)20(16)23/h5-9,14,16-19H,10-13H2,1-4H3/t16-,17-,18+,19+,22-/m1/s1
InChIKey XDYVGSLAZSCWPJ-ZBHHGKBUSA-N
Mol Weight 374.54 g/mol
Molecular Formula C22H30O3S
Exact Mass 374.191566 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Wfah8o81dL
Name XDYVGSLAZSCWPJ-ZBHHGKBUSA-N
CAS Registry Number 77462-51-2
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O3S
InChI InChI=1S/C22H30O3S/c1-14(2)16-12-13-22(3)18(26-15-8-6-5-7-9-15)11-10-17(21(24)25-4)19(22)20(16)23/h5-9,14,16-19H,10-13H2,1-4H3/t16-,17-,18+,19+,22-/m1/s1
InChIKey XDYVGSLAZSCWPJ-ZBHHGKBUSA-N
Literature Reference Author J.R.WILLIAMS,J.F.CALLHAN,J.F.BLOUNT
Literature Reference Citation J.ORG.CHEM.,46,2665(1981)
Literature Reference DOI 10.1021/jo00326a011
Molecular Weight 374.538 g/mol
Solvent CDCl3
Source File Reference UWCS11031