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2-Bromoacetic acid 3-[(8R,9S,13S,14S,17R)-3,17-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl ester

Compound with spectra: 1 NMR, and 1 MS (GC)

2-Bromoacetic acid 3-[(8R,9S,13S,14S,17R)-3,17-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl ester
SpectraBase Compound ID 3xpbxt0QBcO
InChI InChI=1S/C23H31BrO4/c1-22-10-7-18-17-6-4-16(25)13-15(17)3-5-19(18)20(22)8-11-23(22,27)9-2-12-28-21(26)14-24/h4,6,13,18-20,25,27H,2-3,5,7-12,14H2,1H3/t18-,19-,20+,22+,23+/m1/s1
InChIKey QHCQRUVEJHDCDR-IDNQLYMWSA-N
Mol Weight 451.4 g/mol
Molecular Formula C23H31BrO4
Exact Mass 450.140572 g/mol
Enantiomer InChIKey QHCQRUVEJHDCDR-ZYSLNFODSA-N

View Spectrum of 2-Bromoacetic acid 3-[(8R,9S,13S,14S,17R)-3,17-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl ester

13C NMR Spectrum
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View Spectrum of 2-Bromoacetic acid 3-[(8R,9S,13S,14S,17R)-3,17-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl ester

MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum E1-36-2982-10
  • 3-[(8R,9S,13S,14S,17R)-3,17-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl 2-bromoacetate
  • 3-[(8R,9S,13S,14S,17R)-13-methyl-3,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl 2-bromanylethanoate
17-ALPHA-BUTYL-ESTRADIOL
17.alpha.-(3'-hydroxyprop-1'-yl)estra-1,3,5(10)-trien-3,17.beta.-diol
17-ALPHA-PROPANOL-ESTRADIOL
2-Bromanyl-N-[3-[(8R,9S,13S,14S,17R)-13-methyl-3,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl]ethanamide
N-[3-[(8R,9S,13S,14S,17R)-13-methyl-3,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl]ethanamide
2-iodanyl-N-[3-[(8R,9S,13S,14S,17R)-13-methyl-3,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propyl]ethanamide
17-ALPHA-PROPYL-ESTRADIOL
2-Bromanyl-N-[2-[(8R,9S,13S,14S,17R)-13-methyl-3,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl]ethanamide
3-[(8R,9S,13S,14S,17R)-13-methyl-3,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]propanenitrile
2-[(8R,9S,13S,14S,17R)-13-methyl-3,17-bis(oxidanyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl methanesulfonate
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