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Psammaplysin A acetamide acetate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Psammaplysin A acetamide acetate
SpectraBase Compound ID BkQ76MLSoC7
InChI InChI=1S/C25H27Br4N3O8/c1-13(33)30-7-5-15-9-16(26)22(17(27)10-15)37-8-4-6-31-24(35)20-23(39-14(2)34)25(40-32-20)11-18(28)21(36-3)19(29)12-38-25/h9-10,12,23H,4-8,11H2,1-3H3,(H,30,33)(H,31,35)
InChIKey LULWVVCZUMUSTL-UHFFFAOYSA-N
Mol Weight 817.12 g/mol
Molecular Formula C25H27Br4N3O8
Exact Mass 812.853167 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I6RNAScp3m0
Name Psammaplysin A acetamide acetate
CAS Registry Number 95739-54-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H27Br4N3O8
InChI InChI=1S/C25H27Br4N3O8/c1-13(33)30-7-5-15-9-16(26)22(17(27)10-15)37-8-4-6-31-24(35)20-23(39-14(2)34)25(40-32-20)11-18(28)21(36-3)19(29)12-38-25/h9-10,12,23H,4-8,11H2,1-3H3,(H,30,33)(H,31,35)
InChIKey LULWVVCZUMUSTL-UHFFFAOYSA-N
Literature Reference D.M. Roll, C.W. Chang, P.J. Scheuer, J. Am. Chem. Soc. 107, 2916 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2