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3,3a,4,5,8,8a-Hexahydro-2H-azulen-1-one
SpectraBase Compound ID LXe3PFzZoZW
InChI InChI=1S/C10H14O/c11-10-7-6-8-4-2-1-3-5-9(8)10/h1,3,8-9H,2,4-7H2/t8-,9+/m1/s1
InChIKey WKOMUHRFQOCLKF-BDAKNGLRSA-N
Mol Weight 150.22 g/mol
Molecular Formula C10H14O
Exact Mass 150.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ktl2aQ1Hjk
Name 3,3a,4,5,8,8a-Hexahydro-2H-azulen-1-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O
InChI InChI=1S/C10H14O/c11-10-7-6-8-4-2-1-3-5-9(8)10/h1,3,8-9H,2,4-7H2/t8-,9+/m1/s1
InChIKey WKOMUHRFQOCLKF-BDAKNGLRSA-N
Molecular Weight 150.221 g/mol
SMILES C1([C@@]2([C@](CCC=CC2)(CC1)[H])[H])=O
SPLASH splash10-0pdi-9700000000-5c786367d7815cdea6e6
Source of Spectrum F-51-13012-17
Synonyms (3aR,8aS)-3,3a,4,5,8,8a-Hexahydro-2H-azulen-1-one 3,3a,4,5,8,8a-hexahydro-1(2H)-azulenone
Wiley ID 794388