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E-Eremophila-1(10),7(11)-dien-12-yl-methyl ether
SpectraBase Compound ID 57s2JmNdyB9
InChI InChI=1S/C16H26O/c1-12(11-17-4)14-8-9-15-7-5-6-13(2)16(15,3)10-14/h7,13H,5-6,8-11H2,1-4H3/b14-12+/t13-,16+/m1/s1
InChIKey QXOBNGNKLWIWPZ-WMGVVHKYSA-N
Mol Weight 234.38 g/mol
Molecular Formula C16H26O
Exact Mass 234.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AU9yUrMisTB
Name E-Eremophila-1(10),7(11)-dien-12-yl-methyl ether
Classification Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
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 234.198365456 u
Formula C16H26O
InChI InChI=1S/C16H26O/c1-12(11-17-4)14-8-9-15-7-5-6-13(2)16(15,3)10-14/h7,13H,5-6,8-11H2,1-4H3/b14-12+/t13-,16+/m1/s1
InChIKey QXOBNGNKLWIWPZ-WMGVVHKYSA-N
Molecular Weight 234.383 g/mol
Number of Peaks 37
SMILES C\C(=C\1CCC2=CCC[C@]([C@@]2(C1)C)(C)[H])COC
SPLASH splash10-0uyv-3920000000-8c7bacdfb44b4c18c238
Source of Spectrum FF-15-159-M_41 (DOI: 10.1002_1099-1026(200005_06)15_3_153)
Synonyms Isovalencenyl methyl ether (4aS,5R,E)-3-(1-methoxypropan-2-ylidene)-4a,5-dimethyl-1,2,3,4,4a,5,6,7-octahydronaphthalene
Wiley ID 1783008