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17β-Estradiol

View entire compound with spectra: 8 NMR, 5 FTIR, 2 Raman, and 6 MS (GC)

17β-Estradiol
SpectraBase Compound ID 4hlPfMhVOrc
InChI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1
InChIKey VOXZDWNPVJITMN-ZBRFXRBCSA-N
Mol Weight 272.39 g/mol
Molecular Formula C18H24O2
Exact Mass 272.17763 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID IqzGQDkyMsU
Name 17β-Estradiol
Source of Sample SCHERING CORPORATION, BLOOMFIELD, NEW JERSEY
CAS Registry Number 50-28-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O2
InChI InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1
InChIKey VOXZDWNPVJITMN-ZBRFXRBCSA-N
Melting Point 176-177C
Molecular Weight 272.388000
RTECS Number KG2975000
Solubility Soluble in= DIOXANE
Synonyms 3,17-beta-DIHYDROXYESTRA-1,3,5(10)-TRIENE DIHYDROXYOESTRIN DIHYDROFOLLICULIN 3,17-beta-ESTRADIOL 17B-ESTRADIOL /OR A-ESTRADIOL/ ESTRA-1,3,5/10/-TRIENE-3,17B-DIOL ESTRIN, DIHYDROXY-, ESTRADIOL DIHYDROTHEELIN
Technique KBr WAFER