| SpectraBase Spectrum ID |
RfgzELaycs |
| Name |
N-Methoxy-N-methyl-2-phenylsulfonyl-4,5:6,7-bis(isopropylidenedioxy)heptanamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
457.177038128 u |
| Formula |
C21H31NO8S |
| InChI |
InChI=1S/C21H31NO8S/c1-20(2)27-13-16(29-20)18-15(28-21(3,4)30-18)12-17(19(23)22(5)26-6)31(24,25)14-10-8-7-9-11-14/h7-11,15-18H,12-13H2,1-6H3/t15-,16-,17?,18+/m1/s1 |
| InChIKey |
NHYPDSVKVNJOKC-KQWXFDBXSA-N |
| Molecular Weight |
457.538 g/mol |
| SMILES |
C(S(=O)(=O)C1=CC=CC=C1)(C(N(OC)C)=O)C[C@@]1([C@@]([C@@]2(OC(C)(C)OC2)[H])(OC(O1)(C)C)[H])[H] |
