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Trimethyl 6a-methyl-1-1-tosyltetrahydrobenzo[c]pyrrol-3,4,5-tricarboxylate
SpectraBase Compound ID 1PasnKjmZEo
InChI InChI=1S/C22H25NO8S/c1-13-6-8-14(9-7-13)32(27,28)23-11-16-18(21(26)31-5)17(20(25)30-4)15(19(24)29-3)10-22(16,2)12-23/h6-10,16H,11-12H2,1-5H3
InChIKey ZQKKCQGNTFOCAD-UHFFFAOYSA-N
Mol Weight 463.5 g/mol
Molecular Formula C22H25NO8S
Exact Mass 463.130088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4alNM3JWk4Y
Name Trimethyl 6a-methyl-1-1-tosyltetrahydrobenzo[c]pyrrol-3,4,5-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO8S
InChI InChI=1S/C22H25NO8S/c1-13-6-8-14(9-7-13)32(27,28)23-11-16-18(21(26)31-5)17(20(25)30-4)15(19(24)29-3)10-22(16,2)12-23/h6-10,16H,11-12H2,1-5H3
InChIKey ZQKKCQGNTFOCAD-UHFFFAOYSA-N
Molecular Weight 463.501 g/mol
SMILES C1N(S(c2ccc(cc2)C)(=O)=O)CC2(C=C(C(=C(C12)C(=O)OC)C(=O)OC)C(=O)OC)C
SPLASH splash10-0059-0050900000-ae8fe866f937b0ee8c1c
Source of Spectrum F-69-6705-11
Wiley ID 1595629