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19-NOR-4-ANDROSTEN-3-ON, 17-(3-PHENYLPROPANOYLOXY)-
SpectraBase Compound ID CrWtHMG2w1a
InChI InChI=1S/C27H34O3/c1-27-16-15-22-21-11-9-20(28)17-19(21)8-10-23(22)24(27)12-13-25(27)30-26(29)14-7-18-5-3-2-4-6-18/h2-6,17,21-25H,7-16H2,1H3/t21-,22+,23+,24-,25?,27-/m0/s1
InChIKey UBWXUGDQUBIEIZ-VTEBZJCDSA-N
Mol Weight 406.6 g/mol
Molecular Formula C27H34O3
Exact Mass 406.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnyEsvLgfsF
Name 19-NOR-4-ANDROSTEN-3-ON, 17-(3-PHENYLPROPANOYLOXY)-
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 406.250794952 u
Formula C27H34O3
InChI InChI=1S/C27H34O3/c1-27-16-15-22-21-11-9-20(28)17-19(21)8-10-23(22)24(27)12-13-25(27)30-26(29)14-7-18-5-3-2-4-6-18/h2-6,17,21-25H,7-16H2,1H3/t21-,22+,23+,24-,25?,27-/m0/s1
InChIKey UBWXUGDQUBIEIZ-VTEBZJCDSA-N
Molecular Weight 406.566 g/mol
Nominal Mass 406 u
Number of Peaks 182
SMILES C1(CC[C@@]2([C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(CCC2=C1)[H])[H])OC(CCc1ccccc1)=O)C)[H])[H])=O
SPLASH splash10-0a4i-5930000000-eac264d039244c719b56
Source File Reference LMCM-77148-719N
Source of Spectrum Prof. D. Henneberg, MPI f. Kohlenforschung, Muelheim a.d.R., Germany
Synonyms (1S,2R,10R,11S,15S)-15-methyl-5-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-6-en-14-yl 3-phenylpropanoate 3-OXOESTR-4-EN-17-YL 3-PHENYLPROPANOATE
Wiley ID 8_24084