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2-(Phenylmethyl)-6,7-dihydro-6,6-dimethyl-4(5H)-benzofuranone
SpectraBase Compound ID ELiB8HgaWBY
InChI InChI=1S/C17H18O2/c1-17(2)10-15(18)14-9-13(19-16(14)11-17)8-12-6-4-3-5-7-12/h3-7,9H,8,10-11H2,1-2H3
InChIKey XNYAQXHKSNSUFI-UHFFFAOYSA-N
Mol Weight 254.33 g/mol
Molecular Formula C17H18O2
Exact Mass 254.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JpUizob582V
Name 2-(Phenylmethyl)-6,7-dihydro-6,6-dimethyl-4(5H)-benzofuranone
Alternate Name(s) 2-Benzyl-6,6-dimethyl-6,7-dihydrobenzofuran-4(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2
InChI InChI=1S/C17H18O2/c1-17(2)10-15(18)14-9-13(19-16(14)11-17)8-12-6-4-3-5-7-12/h3-7,9H,8,10-11H2,1-2H3
InChIKey XNYAQXHKSNSUFI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol502371j
Molecular Weight 254.329 g/mol
SMILES C1(C)(C)Cc2oc(Cc3ccccc3)cc2C(=O)C1
SPLASH splash10-0udn-1940000000-f1d729ecb5f8a6df0f26
Source of Spectrum A1-16-4862/SMS23-7d
Wiley ID 1751289