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6-[(1',3'-Benzodioxol-5'-yl)methyl]-tetrahydro-2H-pyran-2-one
SpectraBase Compound ID FhlDvjcOP6c
InChI InChI=1S/C13H14O4/c14-13-3-1-2-10(17-13)6-9-4-5-11-12(7-9)16-8-15-11/h4-5,7,10H,1-3,6,8H2
InChIKey JNXMNGFRKHJOLQ-UHFFFAOYSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yZu3HtM2CW
Name 6-[(1',3'-Benzodioxol-5'-yl)methyl]-tetrahydro-2H-pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4
InChI InChI=1S/C13H14O4/c14-13-3-1-2-10(17-13)6-9-4-5-11-12(7-9)16-8-15-11/h4-5,7,10H,1-3,6,8H2
InChIKey JNXMNGFRKHJOLQ-UHFFFAOYSA-N
Molecular Weight 234.251 g/mol
SMILES C1(OC(CCC1)Cc1cc2OCOc2cc1)=O
SPLASH splash10-0019-9850000000-237b1822c299b6a69485
Source of Spectrum H-84-169-3
Synonyms 6-(1,3-benzodioxol-5-ylmethyl)tetrahydro-2H-pyran-2-one
Wiley ID 847437