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Methyl 2-[3.beta.-acetoxy-5,7,9-estratrien-17-yl]propionate

View entire compound with spectra: 1 NMR, and 1 FTIR

Methyl 2-[3.beta.-acetoxy-5,7,9-estratrien-17-yl]propionate
SpectraBase Compound ID 80p3LnyLhVo
InChI InChI=1S/C24H32O4/c1-14(23(26)27-4)21-9-10-22-20-7-5-16-13-17(28-15(2)25)6-8-18(16)19(20)11-12-24(21,22)3/h5,7,14,17,21-22H,6,8-13H2,1-4H3
InChIKey JYZFQWZAULSCKM-UHFFFAOYSA-N
Mol Weight 384.5 g/mol
Molecular Formula C24H32O4
Exact Mass 384.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6UO1h5FhOSD
Name Methyl 2-[3.beta.-acetoxy-5,7,9-estratrien-17-yl]propionate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 384.230059506 u
Formula C24H32O4
InChI InChI=1S/C24H32O4/c1-14(23(26)27-4)21-9-10-22-20-7-5-16-13-17(28-15(2)25)6-8-18(16)19(20)11-12-24(21,22)3/h5,7,14,17,21-22H,6,8-13H2,1-4H3
InChIKey JYZFQWZAULSCKM-UHFFFAOYSA-N
Molecular Weight 384.516 g/mol
SMILES C1C2=C3CCC(CC3=CC=C2C2C(C1)(C(C(C(=O)OC)C)CC2)C)OC(=O)C