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endo-(4aR,8SR,8aSR)-8a-(Benzyloxycarbonyl)-8-methoxy-1,6-dioxo-2-(p-toluenesulfonyl)perhydroisoquinoline
SpectraBase Compound ID 4e3z1sOzyd9
InChI InChI=1S/C25H27NO7S/c1-17-8-10-21(11-9-17)34(30,31)26-13-12-19-14-20(27)15-22(32-2)25(19,23(26)28)24(29)33-16-18-6-4-3-5-7-18/h3-11,19,22H,12-16H2,1-2H3/t19-,22?,25?/m1/s1
InChIKey DKJWLWACRCEIPB-FMGIXGHUSA-N
Mol Weight 485.55 g/mol
Molecular Formula C25H27NO7S
Exact Mass 485.150823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDbUHYqV0bQ
Name endo-(4aR,8SR,8aSR)-8a-(Benzyloxycarbonyl)-8-methoxy-1,6-dioxo-2-(p-toluenesulfonyl)perhydroisoquinoline
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27NO7S
InChI InChI=1S/C25H27NO7S/c1-17-8-10-21(11-9-17)34(30,31)26-13-12-19-14-20(27)15-22(32-2)25(19,23(26)28)24(29)33-16-18-6-4-3-5-7-18/h3-11,19,22H,12-16H2,1-2H3/t19-,22?,25?/m1/s1
InChIKey DKJWLWACRCEIPB-FMGIXGHUSA-N
Molecular Weight 485.551 g/mol
SMILES c1(S(N2C(C3(C(CC(C[C@]3(CC2)[H])=O)OC)C(OCc2ccccc2)=O)=O)(=O)=O)ccc(cc1)C
SPLASH splash10-0006-9020000000-acd2a2f0c942c7516459
Source of Spectrum F-56-4034-18
Wiley ID 857281