SpectraBase Compound ID | IbWlORamMje |
---|---|
InChI | InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(52)32(48)24(12-44)62-42)30(16)34(50)28-18(26)8-14(40(57)58)10-20(28)46/h1-10,23-26,31-32,35-38,41-48,51-54H,11-12H2,(H,55,56)(H,57,58)/t23-,24-,25-,26+,31-,32-,35+,36+,37-,38-,41-,42-/m1/s1 |
InChIKey | IPQVTOJGNYVQEO-AIFLABODSA-N |
Mol Weight | 862.7 g/mol |
Molecular Formula | C42H38O20 |
Exact Mass | 862.195644 g/mol |
SpectraBase Spectrum ID | vzrWR9uofk |
---|---|
Name | Sennoside B |
Source of Sample | Fluka, Sigma-Aldrich Inc. |
Catalog Number | 75412 |
Lot Number | BCBF8888V |
CAS Registry Number | 128-57-4 |
Compound Type | Pure |
Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C42H38O20 |
InChI | InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(52)32(48)24(12-44)62-42)30(16)34(50)28-18(26)8-14(40(57)58)10-20(28)46/h1-10,23-26,31-32,35-38,41-48,51-54H,11-12H2,(H,55,56)(H,57,58)/t23-,24-,25-,26+,31-,32-,35+,36+,37-,38-,41-,42-/m1/s1 |
InChIKey | IPQVTOJGNYVQEO-AIFLABODSA-N |
Instrument Name | Bio-Rad FTS |
Source of Spectrum | Forensic Spectral Research |
Technique | ATR-Neat (DuraSamplIR II) |