SpectraBase Compound ID | JW4Pm0X9cOK |
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InChI | InChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3/t17-,18+ |
InChIKey | PBBGSZCBWVPOOL-HDICACEKSA-N |
Mol Weight | 270.37 g/mol |
Molecular Formula | C18H22O2 |
Exact Mass | 270.16198 g/mol |
SpectraBase Spectrum ID | BvJkqBkGaID |
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Name | meso-Hexestrol |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 219681 |
CAS Registry Number | 84-16-2 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C18H22O2 |
InChI | InChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3/t17-,18+ |
InChIKey | PBBGSZCBWVPOOL-HDICACEKSA-N |
Observed nucleus | 1H |
Purity | 99% |
Solvent | CDCl3 & DMSO-d6 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_1HNMR_003177 |