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(3aR,8aR)-2,3,3a,8a-tetrahydro-8a-methyl-6(1H)-azulenone
SpectraBase Compound ID 94KoSO7HAMC
InChI InChI=1S/C11H14O/c1-11-7-2-3-9(11)4-5-10(12)6-8-11/h4-6,8-9H,2-3,7H2,1H3/t9-,11-/m1/s1
InChIKey ILKUHVFPJHTDHW-MWLCHTKSSA-N
Mol Weight 162.23 g/mol
Molecular Formula C11H14O
Exact Mass 162.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JF0lcBMxMTS
Name (3aR,8aR)-2,3,3a,8a-tetrahydro-8a-methyl-6(1H)-azulenone
Alternate Name(s) (3aR,8aR)-3a-methyl-2,3,3a,8a-tetrahydro-6(1H)-azulenone
CAS Registry Number 119327-08-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O
InChI InChI=1S/C11H14O/c1-11-7-2-3-9(11)4-5-10(12)6-8-11/h4-6,8-9H,2-3,7H2,1H3/t9-,11-/m1/s1
InChIKey ILKUHVFPJHTDHW-MWLCHTKSSA-N
Molecular Weight 162.232 g/mol
SMILES [C@@]12(C=CC(=O)C=C[C@]2(CCC1)[H])C
SPLASH splash10-0aou-2900000000-7269738e2b9b40678ec7
Source of Spectrum J-54-1825-21
Wiley ID 1158978