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1-Methyl-20-ethyl 9a,11a-dihydroxy-15-methyloxime-2,3,4,5,20-pentanor-19-carboxyprostanoate n-butylboronate ester
SpectraBase Compound ID 40BOtz6vY89
InChI InChI=1S/C24H42BNO7/c1-5-7-16-25-32-21-17-22(33-25)20(14-15-23(27)29-3)19(21)13-12-18(26-30-4)10-8-9-11-24(28)31-6-2/h19-22H,5-17H2,1-4H3/b26-18-/t19-,20-,21?,22?/m1/s1
InChIKey OJZKCVPWXAKGIL-AJCQVHKBSA-N
Mol Weight 467.4 g/mol
Molecular Formula C24H42BNO7
Exact Mass 467.305433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBR18zIglC4
Name 1-Methyl-20-ethyl 9a,11a-dihydroxy-15-methyloxime-2,3,4,5,20-pentanor-19-carboxyprostanoate n-butylboronate ester
Alternate Name(s) Ethyl (6Z)-8-[(6R,7R)-3-butyl-7-(3-methoxy-3-oxopropyl)-2,4-dioxa-3-borabicyclo[3.2.1]oct-6-yl]-6-(methoxyimino)octanoate
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Formula C24H42BNO7
InChI InChI=1S/C24H42BNO7/c1-5-7-16-25-32-21-17-22(33-25)20(14-15-23(27)29-3)19(21)13-12-18(26-30-4)10-8-9-11-24(28)31-6-2/h19-22H,5-17H2,1-4H3/b26-18-/t19-,20-,21?,22?/m1/s1
InChIKey OJZKCVPWXAKGIL-AJCQVHKBSA-N
Molecular Weight 467.410 g/mol
SMILES C12OB(OC([C@@]([C@]2(CCC(=O)OC)[H])(CC\C(=N/OC)CCCCC(=O)OCC)[H])C1)CCCC
SPLASH splash10-0f79-6394100000-dd6915e3362ba927c351
Source of Spectrum O-29-360-0
Wiley ID 1392162