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[(E)-3-(2,2-Dimethyl-4-oxo-4H-benzo[1,3]dioxin-5-yl)-allyl]-phosphonic acid diethyl ester
SpectraBase Compound ID JjbqmLaOFpA
InChI InChI=1S/C17H23O6P/c1-5-20-24(19,21-6-2)12-8-10-13-9-7-11-14-15(13)16(18)23-17(3,4)22-14/h7-11H,5-6,12H2,1-4H3/b10-8+
InChIKey YDTOBKWECWXLKM-CSKARUKUSA-N
Mol Weight 354.34 g/mol
Molecular Formula C17H23O6P
Exact Mass 354.123225 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FyWTXJdynr
Name [(E)-3-(2,2-Dimethyl-4-oxo-4H-benzo[1,3]dioxin-5-yl)-allyl]-phosphonic acid diethyl ester
Alternate Name(s) (E)-diethyl (3-(2,2-dimethyl-4-oxo-4H-benzo[d][1,3]dioxin-5-yl)allyl)phosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23O6P
InChI InChI=1S/C17H23O6P/c1-5-20-24(19,21-6-2)12-8-10-13-9-7-11-14-15(13)16(18)23-17(3,4)22-14/h7-11H,5-6,12H2,1-4H3/b10-8+
InChIKey YDTOBKWECWXLKM-CSKARUKUSA-N
Literature Reference DOI 10.1021/ol070240k
Molecular Weight 354.339 g/mol
SMILES C(P(OCC)(=O)OCC)\C=C\c1cccc2c1C(=O)OC(C)(C)O2
SPLASH splash10-03dj-0791000000-131e295dc1559541cb4c
Source of Spectrum A1-9-1453/SMS4-5
Wiley ID 1758054