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(2S,3E,6S)-2-Benzyloxymethoxy-6,7-isopropylidenedioxyhept-4-en-3-one
SpectraBase Compound ID 2LTvAXrZr3r
InChI InChI=1S/C18H24O5/c1-14(21-13-20-11-15-7-5-4-6-8-15)17(19)10-9-16-12-22-18(2,3)23-16/h4-10,14,16H,11-13H2,1-3H3/b10-9+/t14-,16-/m0/s1
InChIKey GMJWMJXRORVDGS-OOCSTFOJSA-N
Mol Weight 320.39 g/mol
Molecular Formula C18H24O5
Exact Mass 320.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40Obc8pQ8Hv
Name (2S,3E,6S)-2-Benzyloxymethoxy-6,7-isopropylidenedioxyhept-4-en-3-one
Alternate Name(s) (1E,4S)-4-[(benzyloxy)methoxy]-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-1-penten-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O5
InChI InChI=1S/C18H24O5/c1-14(21-13-20-11-15-7-5-4-6-8-15)17(19)10-9-16-12-22-18(2,3)23-16/h4-10,14,16H,11-13H2,1-3H3/b10-9+/t14-,16-/m0/s1
InChIKey GMJWMJXRORVDGS-OOCSTFOJSA-N
Molecular Weight 320.385 g/mol
SMILES C1(O[C@@](\C=C\C(=O)[C@@](OCOCc2ccccc2)(C)[H])(CO1)[H])(C)C
SPLASH splash10-0006-9000000000-ceded91d1677f10e588b
Source of Spectrum E1-37-1714-0
Wiley ID 1517867