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(1S*,2S*,5R*)-5,8,8-trimethylbicyclo[3.3.0]octane-2-carboxaldehyde
SpectraBase Compound ID Ef1AbsV4ZNl
InChI InChI=1S/C12H20O/c1-11(2)6-7-12(3)5-4-9(8-13)10(11)12/h8-10H,4-7H2,1-3H3/t9-,10+,12-/m1/s1
InChIKey JAXSJBCFVMKAGV-JFGNBEQYSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HqzzB1qVV7d
Name (1S*,2S*,5R*)-5,8,8-trimethylbicyclo[3.3.0]octane-2-carboxaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-11(2)6-7-12(3)5-4-9(8-13)10(11)12/h8-10H,4-7H2,1-3H3/t9-,10+,12-/m1/s1
InChIKey JAXSJBCFVMKAGV-JFGNBEQYSA-N
Literature Reference DOI 10.1002/hlca.19820650806
Molecular Weight 180.291 g/mol
SMILES [C@]12([C@](CC[C@@]1(CCC2(C)C)C)(C=O)[H])[H]
SPLASH splash10-0apj-9500000000-027ec9634651b3687855
Source of Spectrum H-65-2419-16
Synonyms (1S,3aR,6aS)-3a,6,6-trimethyloctahydropentalene-1-carbaldehyde
Wiley ID 1794776