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(3-R,9-R,9A-S)-5,5,9-TRIMETHYL-2,3,5,6,7,8,9,9A-OCTAHYDRO-1-H-BENZO-[7]-ANNULENE-3-CARBALDEHYDE

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(3-R,9-R,9A-S)-5,5,9-TRIMETHYL-2,3,5,6,7,8,9,9A-OCTAHYDRO-1-H-BENZO-[7]-ANNULENE-3-CARBALDEHYDE
SpectraBase Compound ID B3LKh1xSct5
InChI InChI=1S/C15H24O/c1-11-5-4-8-15(2,3)14-9-12(10-16)6-7-13(11)14/h9-13H,4-8H2,1-3H3/t11-,12-,13+/m1/s1
InChIKey JGHPPNJNIGZKDH-UPJWGTAASA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6lCGBniyVZH
Name (3S,9R,9aS)-5,5,9-trimethyl-2,3,5,6,7,8,9,9a-octahydro-1H-benzo[7]-annulene-3-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-11-5-4-8-15(2,3)14-9-12(10-16)6-7-13(11)14/h9-13H,4-8H2,1-3H3/t11-,12-,13+/m1/s1
InChIKey JGHPPNJNIGZKDH-UPJWGTAASA-N
Instrument Name Hewlett-Packard 5973
Ionization Type EI
Literature Reference DOI 10.1021/np100608p
Molecular Weight 220.356 g/mol
Reported Formula C15H24O
SMILES C1[C@](C=C2[C@@](C1)([C@@](CCCC2(C)C)(C)[H])[H])(C=O)[H]
SPLASH splash10-052f-9500000000-28fbb3e9dd6bf42f4e17
Source of Spectrum G4-74-587-10
Wiley ID 1849071