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(4aS,7aR)-6-Phenyl-4,4a,7,7a-tetrahydropentalen-1(2H)-one
SpectraBase Compound ID BMzpQGt8uCK
InChI InChI=1S/C15H16O/c16-15-8-4-7-12-9-13(10-14(12)15)11-5-2-1-3-6-11/h1-3,5-6,9,12,14H,4,7-8,10H2/t12-,14+/m0/s1
InChIKey VUYFTKBBJWMXNO-GXTWGEPZSA-N
Mol Weight 212.29 g/mol
Molecular Formula C15H16O
Exact Mass 212.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0CWcedwGvm
Name (4aS,7aR)-6-Phenyl-4,4a,7,7a-tetrahydropentalen-1(2H)-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.120115134 u
Formula C15H16O
InChI InChI=1S/C15H16O/c16-15-8-4-7-12-9-13(10-14(12)15)11-5-2-1-3-6-11/h1-3,5-6,9,12,14H,4,7-8,10H2/t12-,14+/m0/s1
InChIKey VUYFTKBBJWMXNO-GXTWGEPZSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901096
Molecular Weight 212.292 g/mol
Quality 553
Reported Formula C15H16O
SMILES C1C([C@]2([C@@](CC1)(C=C(C2)C1=CC=CC=C1)[H])[H])=O
SPLASH splash10-03di-2970000000-aa10137eeff46375751c
Source of Spectrum K1-2019-SM6-9d (DOI: 10.1002/ejoc.201901096)
Thin-Layer Chromatography 0.40 (hexane/EtOAc, 10:1)
Wiley ID 1892243