| SpectraBase Compound ID | A7JoWxvwdMl |
|---|---|
| InChI | InChI=1S/C32H50N2O7S2/c1-23-15-17-27(18-16-23)43(38,39)33-29(40-4)30(35)41-28-21-24-19-20-32(28,31(24,2)3)22-42(36,37)34(25-11-7-5-8-12-25)26-13-9-6-10-14-26/h15-18,24-26,28-29,33H,5-14,19-22H2,1-4H3/t24-,28+,29-,32-/m0/s1 |
| InChIKey | VFBCSHITQJOBAE-VYAKLJJZSA-N |
| Mol Weight | 638.9 g/mol |
| Molecular Formula | C32H50N2O7S2 |
| Exact Mass | 638.305944 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HmKaigLhF9Q |
|---|---|
| Name | N-((2'S)-N'-p-Toluenesulphonylmethoxyglycine)-10-N,N-dicyclohexylsulphamoyl-(2R)-isoborneyl ester- |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H50N2O7S2 |
| InChI | InChI=1S/C32H50N2O7S2/c1-23-15-17-27(18-16-23)43(38,39)33-29(40-4)30(35)41-28-21-24-19-20-32(28,31(24,2)3)22-42(36,37)34(25-11-7-5-8-12-25)26-13-9-6-10-14-26/h15-18,24-26,28-29,33H,5-14,19-22H2,1-4H3/t24-,28+,29-,32-/m0/s1 |
| InChIKey | VFBCSHITQJOBAE-VYAKLJJZSA-N |
| Molecular Weight | 638.879 g/mol |
| SMILES | N(S(c1ccc(cc1)C)(=O)=O)[C@](C(O[C@]1([C@]2(CS(N(C3CCCCC3)C3CCCCC3)(=O)=O)C([C@@](CC2)(C1)[H])(C)C)[H])=O)(OC)[H] |
| SPLASH | splash10-0udi-0171904000-9c9eed073b3fe9e8f52d |
| Source of Spectrum | KD-14-1165-5 |
| Wiley ID | 1636001 |