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(-)-Pinanediol (1R,2R)-2-benzyloxy-4-[tert-butoxycarbonyl]-1-vinylbutaneboronate
SpectraBase Compound ID FyWX0eaDjCZ
InChI InChI=1S/C28H41BO5/c1-8-21(29-33-24-17-20-16-23(27(20,5)6)28(24,7)34-29)22(14-15-25(30)32-26(2,3)4)31-18-19-12-10-9-11-13-19/h8-13,20-24H,1,14-18H2,2-7H3/t20?,21-,22-,23?,24+,28-/m1/s1
InChIKey WBZLJTPUXIXGMA-JKRPTWDBSA-N
Mol Weight 468.4 g/mol
Molecular Formula C28H41BO5
Exact Mass 468.304705 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1cywHs2xJWs
Name (-)-Pinanediol (1R,2R)-2-benzyloxy-4-[tert-butoxycarbonyl]-1-vinylbutaneboronate
Alternate Name(s) tert-Butyl (4R,5R)-4-(benzyloxy)-5-[(2R,6S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0(2,6)]dec-4-yl]-6-heptenoate
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Formula C28H41BO5
InChI InChI=1S/C28H41BO5/c1-8-21(29-33-24-17-20-16-23(27(20,5)6)28(24,7)34-29)22(14-15-25(30)32-26(2,3)4)31-18-19-12-10-9-11-13-19/h8-13,20-24H,1,14-18H2,2-7H3/t20?,21-,22-,23?,24+,28-/m1/s1
InChIKey WBZLJTPUXIXGMA-JKRPTWDBSA-N
Molecular Weight 468.441 g/mol
SMILES [C@@]12(OB(O[C@]1(CC1C(C2C1)(C)C)[H])[C@](C=C)([C@](OCc1ccccc1)(CCC(OC(C)(C)C)=O)[H])[H])C
SPLASH splash10-0006-9700000000-1afb59bd120208305eeb
Source of Spectrum KC-61-4434-8
Wiley ID 1629041