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(1R,3aR,8R,8aR)-1-methyl-8-oxidanyl-2,3,3a,5,6,7,8,8a-octahydro-1H-azulen-4-one
SpectraBase Compound ID 7UaZWjeX7QI
InChI InChI=1S/C11H18O2/c1-7-5-6-8-9(12)3-2-4-10(13)11(7)8/h7-8,10-11,13H,2-6H2,1H3/t7-,8+,10-,11-/m1/s1
InChIKey DPNXGUFOBXNIDH-JZSSXWJLSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2C3ymoU5rvr
Name (1R,3aR,8R,8aR)-1-methyl-8-oxidanyl-2,3,3a,5,6,7,8,8a-octahydro-1H-azulen-4-one
CAS Registry Number 132842-96-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-7-5-6-8-9(12)3-2-4-10(13)11(7)8/h7-8,10-11,13H,2-6H2,1H3/t7-,8+,10-,11-/m1/s1
InChIKey DPNXGUFOBXNIDH-JZSSXWJLSA-N
Molecular Weight 182.263 g/mol
SMILES O[C@]1([C@]2([C@](C(=O)CCC1)(CC[C@]2(C)[H])[H])[H])[H]
SPLASH splash10-0bu0-3900000000-a20ba9af444bea94656d
Source of Spectrum F-46-7245-14
Synonyms (1R,3aR,8R,8aR)-8-hydroxy-1-methyl-2,3,3a,5,6,7,8,8a-octahydro-1H-azulen-4-one
Wiley ID 1178796