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3-Hydroxy-estra-1,3,5(10)-triene

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3-Hydroxy-estra-1,3,5(10)-triene
SpectraBase Compound ID GcLIK59LV8o
InChI InChI=1S/C18H24O/c1-18-9-2-3-17(18)16-6-4-12-11-13(19)5-7-14(12)15(16)8-10-18/h5,7,11,15-17,19H,2-4,6,8-10H2,1H3
InChIKey HJKVPZJVBHWFCQ-UHFFFAOYSA-N
Mol Weight 256.39 g/mol
Molecular Formula C18H24O
Exact Mass 256.182715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 87j1xsR8inY
Name 3-Hydroxy-estra-1,3,5(10)-triene
CAS Registry Number 53-63-4
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H24O
InChI InChI=1S/C18H24O/c1-18-9-2-3-17(18)16-6-4-12-11-13(19)5-7-14(12)15(16)8-10-18/h5,7,11,15-17,19H,2-4,6,8-10H2,1H3
InChIKey HJKVPZJVBHWFCQ-UHFFFAOYSA-N
Instrument Name Varian HA-100
Literature Reference T.A. Wittstruck, K.I. Williams, J. Org. Chem. 38, 1542 (1973).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Dioxane