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17-Methoxy-D-homo-18-norandrosta-4,8,13,15,17-pentaen-3-one

View entire compound with spectra: 1 FTIR

17-Methoxy-D-homo-18-norandrosta-4,8,13,15,17-pentaen-3-one
SpectraBase Compound ID 9uM4Go4y6DM
InChI InChI=1S/C20H22O2/c1-20-10-9-15(21)12-14(20)4-6-18-17-7-5-16(22-2)11-13(17)3-8-19(18)20/h5,7,11-12H,3-4,6,8-10H2,1-2H3
InChIKey LIWPFSRVWYAGHN-UHFFFAOYSA-N
Mol Weight 294.39 g/mol
Molecular Formula C20H22O2
Exact Mass 294.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FzHqAqnNx0F
Name 17-Methoxy-D-homo-18-norandrosta-4,8,13,15,17-pentaen-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.161979946 u
Formula C20H22O2
InChI InChI=1S/C20H22O2/c1-20-10-9-15(21)12-14(20)4-6-18-17-7-5-16(22-2)11-13(17)3-8-19(18)20/h5,7,11-12H,3-4,6,8-10H2,1-2H3
InChIKey LIWPFSRVWYAGHN-UHFFFAOYSA-N
SMILES C1=C(C=C2C(=C1)C1=C(CC2)C2(C(=CC(=O)CC2)CC1)C)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.874815