SpectraBase Compound ID | 8Fkc76hZcGE |
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InChI | InChI=1S/C37H52Cl2N2O7/c1-3-4-5-6-7-11-25-44-37-33(40-27(2)42)35(34-31(46-37)26-45-36(48-34)29-14-9-8-10-15-29)47-32(43)16-12-13-28-17-19-30(20-18-28)41(23-21-38)24-22-39/h8-10,14-15,17-20,31,33-37H,3-7,11-13,16,21-26H2,1-2H3,(H,40,42)/t31-,33-,34-,35-,36-,37-/m1/s1 |
InChIKey | JHXZLQSTCWPFOL-WTHBACDCSA-N |
Mol Weight | 707.7 g/mol |
Molecular Formula | C37H52Cl2N2O7 |
Exact Mass | 706.315157 g/mol |
SpectraBase Spectrum ID | I7Rkc1yQPS5 |
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Name | 1-OCTYL-DERIVATIVE |
Compound Number | 9 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C37H52Cl2N2O7 |
InChI | InChI=1S/C37H52Cl2N2O7/c1-3-4-5-6-7-11-25-44-37-33(40-27(2)42)35(34-31(46-37)26-45-36(48-34)29-14-9-8-10-15-29)47-32(43)16-12-13-28-17-19-30(20-18-28)41(23-21-38)24-22-39/h8-10,14-15,17-20,31,33-37H,3-7,11-13,16,21-26H2,1-2H3,(H,40,42)/t31-,33-,34-,35-,36-,37-/m1/s1 |
InChIKey | JHXZLQSTCWPFOL-WTHBACDCSA-N |
Literature Reference Author | F.IGLESIAS-GUERRA,J.I.CANDELA,J.BAUTISTA,F.ALCUDIA,J.M.VEGA- PEREZ |
Literature Reference Citation | CARBOHYDR.RES.,316,71(1999) |
Literature Reference DOI | 10.1016/S0008-6215(99)00030-0 |
Molecular Weight | 707.735 g/mol |
Solvent | CDCl3 |
Source File Reference | UWMP15096 |