SpectraBase Compound ID | 5uHtg1XGXGD |
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InChI | InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1 |
InChIKey | FVWJYYTZTCVBKE-ROUWMTJPSA-N |
Mol Weight | 442.7 g/mol |
Molecular Formula | C30H50O2 |
Exact Mass | 442.381081 g/mol |
SpectraBase Spectrum ID | 62ed9URcMwo |
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Name | Betulin |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 123765 |
CAS Registry Number | 473-98-3 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C30H50O2 |
InChI | InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1 |
InChIKey | FVWJYYTZTCVBKE-ROUWMTJPSA-N |
Observed nucleus | 1H |
Purity | 97% |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_1HNMR_000616 |