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Megestrol acetate
SpectraBase Compound ID 69fi1Lk1yq7
InChI InChI=1S/C24H32O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h12-13,18-20H,6-11H2,1-5H3/t18-,19+,20+,22-,23+,24+/m1/s1
InChIKey RQZAXGRLVPAYTJ-GQFGMJRRSA-N
Mol Weight 384.5 g/mol
Molecular Formula C24H32O4
Exact Mass 384.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mI39aUNAib
Name 17.ALPHA.-ACETOXY-6-METHYL-PREGNA-4,6-DIENE-3,20-DIONE
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Exact Mass 384.230059506 u
Formula C24H32O4
InChI InChI=1S/C24H32O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h12-13,18-20H,6-11H2,1-5H3/t18-,19+,20+,22-,23+,24+/m1/s1
InChIKey RQZAXGRLVPAYTJ-GQFGMJRRSA-N
Molecular Weight 384.516 g/mol
Nominal Mass 384 u
Number of Peaks 32
SMILES C1(CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(C=C(C2=C1)C)[H])[H])(C(C)=O)OC(=O)C)C)[H])C)=O
SPLASH splash10-001i-5190000000-3fb77fb486df0ddc9e2b
Source File Reference LMCM-96392-548L
Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
Synonyms 6-METHYL-3,20-DIOXOPREGNA-4,6-DIEN-17-YL ACETATE (8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-3-oxo-2,3,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl acetate
Wiley ID 4_246