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(4R,S)4-Isopropyl-trans-bicyclo(4.3.0)-2-nonen-8-one
SpectraBase Compound ID CdbjeAmXR2V
InChI InChI=1S/C12H18O/c1-8(2)9-3-4-10-6-12(13)7-11(10)5-9/h3-4,8-11H,5-7H2,1-2H3/t9?,10-,11-/m0/s1
InChIKey MCPMTHWCECWQLZ-DVRYWGNFSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XivaYCSRwQ
Name (4R,S)4-Isopropyl-trans-bicyclo(4.3.0)-2-nonen-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-8(2)9-3-4-10-6-12(13)7-11(10)5-9/h3-4,8-11H,5-7H2,1-2H3/t9?,10-,11-/m0/s1
InChIKey MCPMTHWCECWQLZ-DVRYWGNFSA-N
Molecular Weight 178.275 g/mol
SMILES [C@]12([C@@](C=CC(C2)C(C)C)(CC(C1)=O)[H])[H]
SPLASH splash10-002f-9300000000-86e33784ed4d0cdbc747
Source of Spectrum FV-5-0-0
Synonyms (3aS,7aS)-5-isopropyl-1,3,3a,4,5,7a-hexahydro-2H-inden-2-one
Wiley ID 1174621