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1,3,5(10)-ESTRATRIEN-17-ALPHA-ETHYNYL-3-BETA,17-BETA-DIOL-3-METHYLETHER

View entire compound with spectra: 1 NMR, and 7 MS (GC)

1,3,5(10)-ESTRATRIEN-17-ALPHA-ETHYNYL-3-BETA,17-BETA-DIOL-3-METHYLETHER
SpectraBase Compound ID 5r7Yroem5A6
InChI InChI=1S/C21H26O2/c1-4-21(22)12-10-19-18-7-5-14-13-15(23-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,6,8,13,17-19,22H,5,7,9-12H2,2-3H3
InChIKey IMSSROKUHAOUJS-UHFFFAOYSA-N
Mol Weight 310.44 g/mol
Molecular Formula C21H26O2
Exact Mass 310.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDyHvykc0UT
Name 19-Norpregna-1,3,5(10)-trien-20-yn-17-ol, 3-methoxy-, (17.alpha.)-
CAS Registry Number 72-33-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O2
InChI InChI=1S/C21H26O2/c1-4-21(22)12-10-19-18-7-5-14-13-15(23-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,6,8,13,17-19,22H,5,7,9-12H2,2-3H3
InChIKey IMSSROKUHAOUJS-UHFFFAOYSA-N
Molecular Weight 310.437 g/mol
SMILES OC1(CCC2C1(C)CCC1C2CCc2c1ccc(OC)c2)C#C
SPLASH splash10-01t9-1951000000-223b1e470d18ac5d56c5
Source of Spectrum DE-0-20-0
Synonyms (17-alpha)-3-Methoxy-19-norpregna-1,3,5(10)-trien-20-yn-17-ol .delta.-MVE 17-.alpha.-Ethynyl-3-methoxy-1,3,5(10)-estratrien-17-.beta.-ol 17-.alpha.-Ethynyloestradiol methyl ether 17-Ethynyl-3-methoxy-1,3,5(10)-estratrien-17.beta.-ol 17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol 17-Ethynyl-3-methoxyestra-1,3,5(10)-trien-17-ol 17-Ethynylestradiol 3-methyl ether 17-Ethynyloestradiol 3-methyl ether 17.alpha.-19-norpregna-1,3,5(10)-trien-20-yn-17-ol, 3-meth 17.alpha.-Ethynylestradiol 3-methyl ether 17.alpha.-ethynylestradiol methyl ether 17.alpha.-Ethynyloestradiol 3-methyl ether 19-Norpregna-1,3,5(10)-trien-20-yn-17-ol, 3-methoxy-, (17alpha)- 3,17-.beta.-Dihydroxy-17-.alpha.-ethynyl-1,3,5(10)-estratriene-3-methyl ether 3-Methoxy-17-.alpha.-19-norpregna-1,3,5(10)-trien-20-yn-17-ol 3-Methoxy-17-ethynyloestradiol-17-beta 3-Methoxyethynylestradiol 3-Methoxyethynyloestradiol 3-Methylethynylestradiol 3-Methylethynyloestradiol 3-O-Methylethynylestradiol Component of Norinyl Component of Norquen Component of Ortho-novum Component of Ovulen Delta-mve Devocin EE(SUB3)ME EE3ME Estra-1,3,5(10)-trien-17-.beta.-ol, 17-.alpha.-ethynyl-3-methoxy- Estra-1,3,5(10)-trien-17.beta.-ol, 17-ethynyl-3-methoxy- Ethinylestradiol 3-methyl ether Ethinyloestradiol 3-methyl ether Ethynylestradiol 3-methyl ether Ethynylestradiol methyl ether Ethynyloestradiol 3-methyl ether Inostral Menophase Mestranol Mestranolo Mestranolum Norquen Ovastol 8027 C. B. AI3-51798 BRN 2625905 CASWELL NO. 547A CCRIS 377 COMPOUND 33355 EINECS 200-777-8 EPA PESTICIDE CHEMICAL CODE 115401 HSDB 3588 NSC 84032 SC 4725
Wiley ID 1312021