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rac-(4aS,6S,8aR)-6-Ethyloctahydronaphthalen-2(1H)-one
SpectraBase Compound ID 5jGh08HktOV
InChI InChI=1S/C12H20O/c1-2-9-3-4-11-8-12(13)6-5-10(11)7-9/h9-11H,2-8H2,1H3/t9-,10-,11+/m0/s1
InChIKey ZIJDZRMSPKKGSO-GARJFASQSA-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 39HVbQCxLod
Name rac-(4aS,6S,8aR)-6-Ethyloctahydronaphthalen-2(1H)-one
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-2-9-3-4-11-8-12(13)6-5-10(11)7-9/h9-11H,2-8H2,1H3/t9-,10-,11+/m0/s1
InChIKey ZIJDZRMSPKKGSO-GARJFASQSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/hlca.202100180
Molecular Weight 180.291 g/mol
SMILES C(C)[C@@]1(C[C@]2([C@](CC1)(CC(CC2)=O)[H])[H])[H]
SPLASH splash10-053i-5900000000-f4b064377c00cada0083
Source of Spectrum H-105-10-20
Wiley ID 1873486