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(4bR,9aR)-5,6,7,8,9a,10-Hexahydro-4bH-benzo[a]azulen-9-one
SpectraBase Compound ID 89KhnBPX39t
InChI InChI=1S/C14H16O/c15-14-8-4-3-7-12-11-6-2-1-5-10(11)9-13(12)14/h1-2,5-6,12-13H,3-4,7-9H2/t12-,13+/m0/s1
InChIKey VRNRTLIDHFJDTK-QWHCGFSZSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7nclyKo5HL8
Name (4bR,9aR)-5,6,7,8,9a,10-Hexahydro-4bH-benzo[a]azulen-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c15-14-8-4-3-7-12-11-6-2-1-5-10(11)9-13(12)14/h1-2,5-6,12-13H,3-4,7-9H2/t12-,13+/m0/s1
InChIKey VRNRTLIDHFJDTK-QWHCGFSZSA-N
Molecular Weight 200.281 g/mol
SMILES [C@]12([C@](c3ccccc3C2)(CCCCC1=O)[H])[H]
SPLASH splash10-0uyl-0930000000-83a4dbf4fd1d285ff531
Source of Spectrum F-50-12590-40
Wiley ID 790037