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Ethyl (1S,2R,3S,5S)-2-Methyl-5-(prop-1-en-2-yl)-3-(tetrahydro-2H-pyran-2-yloxy)cyclopentanecarboxylate
SpectraBase Compound ID IIDQjRufwaq
InChI InChI=1S/C17H28O4/c1-5-19-17(18)16-12(4)14(10-13(16)11(2)3)21-15-8-6-7-9-20-15/h12-16H,2,5-10H2,1,3-4H3/t12-,13+,14-,15?,16+/m0/s1
InChIKey PMLJFNIPJYUZTR-YSEJDXQZSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0B4Ai1p0pO
Name Ethyl (1S,2R,3S,5S)-2-Methyl-5-(prop-1-en-2-yl)-3-(tetrahydro-2H-pyran-2-yloxy)cyclopentanecarboxylate
Alternate Name(s) (1S,2R,3S,5S)-ethyl 2-methyl-5-(prop-1-en-2-yl)-3-((tetrahydro-2H-pyran-2-yl)oxy)cyclopentanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-5-19-17(18)16-12(4)14(10-13(16)11(2)3)21-15-8-6-7-9-20-15/h12-16H,2,5-10H2,1,3-4H3/t12-,13+,14-,15?,16+/m0/s1
InChIKey PMLJFNIPJYUZTR-YSEJDXQZSA-N
Literature Reference DOI 10.1002/cbdv.201400038
Molecular Weight 296.407 g/mol
SMILES [C@@]1([C@]([C@](C[C@@]1(C(=C)C)[H])(OC1CCCCO1)[H])(C)[H])(C(=O)OCC)[H]
SPLASH splash10-0079-9600000000-1fec0be54ce1b3c9c2e2
Source of Spectrum CBD-11-1531-minor_3b
Wiley ID 1771270