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(1S,2S,6R,8S)-2,9,9-trimethyl-4-(phenoxymethyl)-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decane
SpectraBase Compound ID 3Apf8858EV6
InChI InChI=1S/C17H23BO3/c1-16(2)12-9-14(16)17(3)15(10-12)20-18(21-17)11-19-13-7-5-4-6-8-13/h4-8,12,14-15H,9-11H2,1-3H3/t12-,14-,15+,17-/m0/s1
InChIKey YFUCCJZVGUZJRH-FAYQHZLMSA-N
Mol Weight 286.2 g/mol
Molecular Formula C17H23BO3
Exact Mass 286.174025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bv5HIcde3GW
Name (1S,2S,6R,8S)-2,9,9-trimethyl-4-(phenoxymethyl)-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.174024768 u
Formula C17H23BO3
InChI InChI=1S/C17H23BO3/c1-16(2)12-9-14(16)17(3)15(10-12)20-18(21-17)11-19-13-7-5-4-6-8-13/h4-8,12,14-15H,9-11H2,1-3H3/t12-,14-,15+,17-/m0/s1
InChIKey YFUCCJZVGUZJRH-FAYQHZLMSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1021/jacs.2c03621
Quality 718
SMILES [C@@]12(OB(O[C@@]2(C[C@]2(C([C@@]1(C2)[H])(C)C)[H])[H])COC1=CC=CC=C1)C
SPLASH splash10-00mo-9200000000-a1e03932ab7c0f1b470c
Source of Spectrum C-144-SM42-42-2 (DOI: 10.1021/jacs.2c03621)
Wiley ID 1910688