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(4a,9a-(trans)-4,4,8,9a-Tetramethyl-2,3,4,4a,5,6,7,9a-octahydro-1H-benzo[7]annulen-6-yl)methanol
SpectraBase Compound ID 2F2GWIBBQbJ
InChI InChI=1S/C16H28O/c1-12-8-13(11-17)9-14-15(2,3)6-5-7-16(14,4)10-12/h10,13-14,17H,5-9,11H2,1-4H3/t13?,14-,16+/m0/s1
InChIKey HXSBTSGPUNHRTJ-JGKCFBKVSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9EswiZJOSY2
Name (4a,9a-(trans)-4,4,8,9a-Tetramethyl-2,3,4,4a,5,6,7,9a-octahydro-1H-benzo[7]annulen-6-yl)methanol
Classification Primary alcohols
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 236.214015521 u
Formula C16H28O
InChI InChI=1S/C16H28O/c1-12-8-13(11-17)9-14-15(2,3)6-5-7-16(14,4)10-12/h10,13-14,17H,5-9,11H2,1-4H3/t13?,14-,16+/m0/s1
InChIKey HXSBTSGPUNHRTJ-JGKCFBKVSA-N
Molecular Weight 236.399 g/mol
Number of Peaks 22
SMILES OCC1C[C@@]2([C@@](CCCC2(C)C)(C)C=C(C1)C)[H]
SPLASH splash10-0apm-9300000000-50175428255d16abc486
Source of Spectrum FF-29-62-23_isomer1 (DOI: 10.1002/ffj.3180)
Synonyms ((4aS,9aR)-4,4,8,9a-tetramethyl-2,3,4,4a,5,6,7,9a-octahydro-1H-benzo[7]annulen-6-yl)methanol
Wiley ID 1775637