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(E)-Eremophila-1(10),7-(11)dien-12-yl-acetate
SpectraBase Compound ID 4ZgMqm3Z2Dj
InChI InChI=1S/C17H26O2/c1-12(11-19-14(3)18)15-8-9-16-7-5-6-13(2)17(16,4)10-15/h7,13H,5-6,8-11H2,1-4H3/b15-12+/t13-,17+/m1/s1
InChIKey PAGIZIHMWSSCEF-KKRUECSZSA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGXpcBeh9tY
Name (E)-Eremophila-1(10),7-(11)dien-12-yl-acetate
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 262.193280075 u
Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-12(11-19-14(3)18)15-8-9-16-7-5-6-13(2)17(16,4)10-15/h7,13H,5-6,8-11H2,1-4H3/b15-12+/t13-,17+/m1/s1
InChIKey PAGIZIHMWSSCEF-KKRUECSZSA-N
Molecular Weight 262.393 g/mol
Number of Peaks 13
SMILES C1C[C@@](C)([C@]2(C(=C1)CC\C(C2)=C\(C)COC(C)=O)C)[H]
SPLASH splash10-0rld-4910000000-f07aa94e920acf835499
Source of Spectrum FF-15-403-144 (DOI: 10.1002_1099-1026(200011_12)15_6_395)
Synonyms (E)-2-((8R,8aS)-8,8a-dimethyl-3,4,6,7,8,8a-hexahydronaphthalen-2(1H)-ylidene)propyl acetate [(2E)-2-[(8R,8aS)-8,8a-dimethyl-1,3,4,6,7,8-hexahydronaphthalen-2-ylidene]propyl] acetate [(2E)-2-[(8R,8aS)-8,8a-dimethyl-1,3,4,6,7,8-hexahydronaphthalen-2-ylidene]propyl] ethanoate
Wiley ID 1775277