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2-Penten-4-yn-1-ol, 3-methyl-5-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-, acetate, (Z)-(.+-.)-
SpectraBase Compound ID FMUrl5tSkmG
InChI InChI=1S/C17H24O3/c1-13(8-12-19-14(2)18)7-11-17-15(3,4)9-6-10-16(17,5)20-17/h8H,6,9-10,12H2,1-5H3/b13-8-/t16-,17+/m1/s1
InChIKey AJUVTLPJPGSUHE-WJZHFJKWSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5SoIA9Z0ukF
Name 2-Penten-4-yn-1-ol, 3-methyl-5-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-, acetate, (Z)-(.+-.)-
Alternate Name(s) (2Z)-3-methyl-5-[(1R,6R)-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl]-2-penten-4-ynyl acetate 1-Acetoxy-5-(1',2'-epoxy-2',6',6'-trimethylcyclohexyl)-3-methylpent-cis-2-en-4-yne 7-Oxabicyclo[4.1.0]heptane, 2-penten-4-yn-1-ol deriv.
CAS Registry Number 69774-31-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-13(8-12-19-14(2)18)7-11-17-15(3,4)9-6-10-16(17,5)20-17/h8H,6,9-10,12H2,1-5H3/b13-8-/t16-,17+/m1/s1
InChIKey AJUVTLPJPGSUHE-WJZHFJKWSA-N
Molecular Weight 276.376 g/mol
SMILES [C@@]12(O[C@@]2(CCCC1(C)C)C)C#C\C(=C/COC(=O)C)C
SPLASH splash10-0160-0090000000-81af6af6a40a7230f9aa
Source of Spectrum KC-1978-1522-0
Wiley ID 1280310