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5-[(E)-2-phenylethenyl]-3,4,7,7a-tetrahydrocyclopenta[b]pyran-6(2H)-one
SpectraBase Compound ID LLstXlNjR5o
InChI InChI=1S/C16H16O2/c17-15-11-16-14(7-4-10-18-16)13(15)9-8-12-5-2-1-3-6-12/h1-3,5-6,8-9,16H,4,7,10-11H2/b9-8+
InChIKey NZLJYVFFRHLHLR-CMDGGOBGSA-N
Mol Weight 240.3 g/mol
Molecular Formula C16H16O2
Exact Mass 240.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HVwBqov6zXQ
Name 5-[(E)-2-phenylethenyl]-3,4,7,7a-tetrahydrocyclopenta[b]pyran-6(2H)-one
Alternate Name(s) 5-[(E)-2-phenylethenyl]-3,4,7,7a-tetrahydro-2H-cyclopenta[b]pyran-6-one
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Formula C16H16O2
InChI InChI=1S/C16H16O2/c17-15-11-16-14(7-4-10-18-16)13(15)9-8-12-5-2-1-3-6-12/h1-3,5-6,8-9,16H,4,7,10-11H2/b9-8+
InChIKey NZLJYVFFRHLHLR-CMDGGOBGSA-N
Molecular Weight 240.302 g/mol
SMILES C1(=C2C(OCCC2)CC1=O)\C=C\c1ccccc1
SPLASH splash10-03dl-0590000000-51577dc3f8126c88fea0
Source of Spectrum U1-2009-2699-10k
Wiley ID 1663081