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7-(Phenylmethyl)-1,5-benzodioxepin-3-one

View entire compound with spectra: 1 MS (GC)

7-(Phenylmethyl)-1,5-benzodioxepin-3-one
SpectraBase Compound ID 2kCRS913EG
InChI InChI=1S/C16H14O3/c17-14-10-18-15-7-6-13(9-16(15)19-11-14)8-12-4-2-1-3-5-12/h1-7,9H,8,10-11H2
InChIKey NSWAVEYFNBXKOG-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C16H14O3
Exact Mass 254.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMhOpLnxqcH
Name 7-(Phenylmethyl)-1,5-benzodioxepin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O3
InChI InChI=1S/C16H14O3/c17-14-10-18-15-7-6-13(9-16(15)19-11-14)8-12-4-2-1-3-5-12/h1-7,9H,8,10-11H2
InChIKey NSWAVEYFNBXKOG-UHFFFAOYSA-N
Molecular Weight 254.285 g/mol
SMILES c12OCC(COc2ccc(c1)Cc1ccccc1)=O
SPLASH splash10-0udl-2890000000-d4b46a7502dc5f368a3a
Source of Spectrum K1-2003-3742-25
Synonyms 7-Benzyl-1,5-benzodioxepin-3-one
Wiley ID 1521528