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(4S,5S)-4-(6-bromonaphthalen-2-yl)-2,2-dimethyl-1,3-dioxaspiro[4.4]nonan-6-one
SpectraBase Compound ID CwluAtTpJcG
InChI InChI=1S/C19H19BrO3/c1-18(2)22-17(19(23-18)9-3-4-16(19)21)14-6-5-13-11-15(20)8-7-12(13)10-14/h5-8,10-11,17H,3-4,9H2,1-2H3/t17-,19+/m0/s1
InChIKey IJIBCBYKDQJAMR-PKOBYXMFSA-N
Mol Weight 375.26 g/mol
Molecular Formula C19H19BrO3
Exact Mass 374.051757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HDgvUeKidxp
Name (4S,5S)-4-(6-bromonaphthalen-2-yl)-2,2-dimethyl-1,3-dioxaspiro[4.4]nonan-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19BrO3
InChI InChI=1S/C19H19BrO3/c1-18(2)22-17(19(23-18)9-3-4-16(19)21)14-6-5-13-11-15(20)8-7-12(13)10-14/h5-8,10-11,17H,3-4,9H2,1-2H3/t17-,19+/m0/s1
InChIKey IJIBCBYKDQJAMR-PKOBYXMFSA-N
Literature Reference DOI 10.1002/anie.201402765
Molecular Weight 375.262 g/mol
SMILES [C@]12([C@@](OC(O2)(C)C)(c2cc3c(cc(Br)cc3)cc2)[H])C(=O)CCC1
SPLASH splash10-015c-0988000000-151b1fc5421255d0d083
Source of Spectrum ACI-53-SMS-26-arb10
Wiley ID 1782570