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Guaia-1(5),11-dien-3-yl methyl ether
SpectraBase Compound ID J2dxW2E8Vnv
InChI InChI=1S/C16H26O/c1-10(2)13-7-6-11(3)14-9-16(17-5)12(4)15(14)8-13/h11-13,16H,1,6-9H2,2-5H3/t11-,12+,13+,16+/m0/s1
InChIKey XODWWLLRRMISMT-VPWBDBDCSA-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 4U2wA0RyHJg
Name Guaia-1(5),11-dien-3-yl methyl ether
Classification 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/c1-10(2)13-7-6-11(3)14-9-16(17-5)12(4)15(14)8-13/h11-13,16H,1,6-9H2,2-5H3/t11-,12+,13+,16+/m0/s1
InChIKey XODWWLLRRMISMT-VPWBDBDCSA-N
Molecular Weight 234.383 g/mol
Number of Peaks 22
SMILES [C@]1(CC[C@](CC=2[C@]([C@@](CC12)(OC)[H])(C)[H])(C(=C)C)[H])(C)[H]
SPLASH splash10-0a5a-3910000000-18732ba2fc644b942fc0
Source of Spectrum FF-15-159-M_11 (DOI: 10.1002_1099-1026(200005_06)15_3_153)
Synonyms (1R,2R,4S,7R)-2-methoxy-1,4-dimethyl-7-(prop-1-en-2-yl)-1,2,3,4,5,6,7,8-octahydroazulene
Wiley ID 1782995