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(2aS,3S)-7-methoxy-3-[(2'R,3'S)-2'-(t-butyldimethylsilyl)oxy-1'-oxobut-3'-yl]-9-methyl-1-oxo-2,2a,3,4,5,8-hexahydro-1H-benz[cd]azulene-3-carboxylic acid methyl ester
SpectraBase Compound ID BwuhHNFAHzX
InChI InChI=1S/C27H40O6Si/c1-16-12-19(31-6)13-18-10-11-27(25(30)32-7,20-14-21(29)23(16)24(18)20)17(2)22(15-28)33-34(8,9)26(3,4)5/h13,15,17,20,22H,10-12,14H2,1-9H3/t17-,20+,22+,27-/m1/s1
InChIKey QNGBKALVZCSBLF-WCSGGZKSSA-N
Mol Weight 488.7 g/mol
Molecular Formula C27H40O6Si
Exact Mass 488.259416 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QeXQjNs6ec
Name (2aS,3S)-7-methoxy-3-[(2'R,3'S)-2'-(t-butyldimethylsilyl)oxy-1'-oxobut-3'-yl]-9-methyl-1-oxo-2,2a,3,4,5,8-hexahydro-1H-benz[cd]azulene-3-carboxylic acid methyl ester
Alternate Name(s) Methyl (2aS,3S)-3-((1S,2R)-2-{[tert-butyl(dimethyl)silyl]oxy}-1-methyl-3-oxopropyl)-7-methoxy-9-methyl-1-oxo-2,2a,3,4,5,8-hexahydro-1H-benzo[cd]azulene-3-carboxylate Methyl 7-methoxy-3-[2'-(t-butyldimethylsilyl)oxy-1'-oxobut-3'-yl]-9-methyl-1-oxo-2,2a,3,4,5,8-hexahydro-1H-benz[cd]azulene-3-carboxylate
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Formula C27H40O6Si
InChI InChI=1S/C27H40O6Si/c1-16-12-19(31-6)13-18-10-11-27(25(30)32-7,20-14-21(29)23(16)24(18)20)17(2)22(15-28)33-34(8,9)26(3,4)5/h13,15,17,20,22H,10-12,14H2,1-9H3/t17-,20+,22+,27-/m1/s1
InChIKey QNGBKALVZCSBLF-WCSGGZKSSA-N
Molecular Weight 488.696 g/mol
SMILES C=12C=3C(=O)C[C@@]2([C@](C(=O)OC)([C@@]([C@@](O[Si](C(C)(C)C)(C)C)(C=O)[H])(C)[H])CCC1C=C(OC)CC3C)[H]
SPLASH splash10-05a9-5381900000-7f05b8088adb05c877db
Source of Spectrum B-53-828-33
Wiley ID 810978