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17-Acetoxyspiro[androstane-3,4'-.alpha.methylene-.gamma.-butyrolactone] diasterromer
SpectraBase Compound ID FPOPWgRbNU8
InChI InChI=1S/C25H36O4/c1-15-13-25(29-22(15)27)12-11-23(3)17(14-25)5-6-18-19-7-8-21(28-16(2)26)24(19,4)10-9-20(18)23/h17-21H,1,5-14H2,2-4H3/t17-,18?,19?,20?,21-,23-,24-,25-/m0/s1
InChIKey IEMFBSCTQPWKMP-ZJHZRQPNSA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnL0J5R60RX
Name 17-Acetoxyspiro[androstane-3,4'-.alpha.methylene-.gamma.-butyrolactone] diasterromer
Alternate Name(s) 17-Acetoxyspiro[androstane-3,4'-.alpha.methylene-.gamma.-butyrolactone]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-15-13-25(29-22(15)27)12-11-23(3)17(14-25)5-6-18-19-7-8-21(28-16(2)26)24(19,4)10-9-20(18)23/h17-21H,1,5-14H2,2-4H3/t17-,18?,19?,20?,21-,23-,24-,25-/m0/s1
InChIKey IEMFBSCTQPWKMP-ZJHZRQPNSA-N
Molecular Weight 400.559 g/mol
SMILES [C@@]12(C(C3CC[C@@]4([C@@](C3CC2)(CC[C@]2(C4)OC(=O)C(C2)=C)C)[H])CC[C@@]1(OC(=O)C)[H])C
SPLASH splash10-0f97-0309100000-eddf2422dfa4532df11d
Source of Spectrum KC-0-845-2
Wiley ID 824447