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(9R,9aS)-5,5,9-trimethyl-5,6,7,8,9,9a-hexahydro-1H-benzo[7]annulene-3-carbaldehyde
SpectraBase Compound ID B05GEBFDA9Q
InChI InChI=1S/C15H22O/c1-11-5-4-8-15(2,3)14-9-12(10-16)6-7-13(11)14/h6,9-11,13H,4-5,7-8H2,1-3H3/t11-,13+/m1/s1
InChIKey QZUQZHVAAQUHBM-YPMHNXCESA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ehpa8ktU1s
Name (9R,9aS)-5,5,9-trimethyl-5,6,7,8,9,9a-hexahydro-1H-benzo[7]annulene-3-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-11-5-4-8-15(2,3)14-9-12(10-16)6-7-13(11)14/h6,9-11,13H,4-5,7-8H2,1-3H3/t11-,13+/m1/s1
InChIKey QZUQZHVAAQUHBM-YPMHNXCESA-N
Instrument Name Hewlett-Packard 5973
Ionization Type EI
Literature Reference DOI 10.1021/np100608p
Molecular Weight 218.340 g/mol
Reported Formula C15H22O
SMILES C(=O)C=1C=C2C(C)(C)CCC[C@@](C)([C@]2([H])CC1)[H]
SPLASH splash10-00kf-9810000000-5aadc7eccc274ab94352
Source of Spectrum G4-74-587-14
Wiley ID 1849075