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(+-)-(1.alpha.,2.alpha.,5.beta.,6.beta.,9.beta.,11.alpha.)-6-methyl-5-tetrahydropyranyloxy-14-oxatetracylo[7,4,1(1,11)0(2,6)]tetradecan-8-one
SpectraBase Compound ID 6GNrIKRnK09
InChI InChI=1S/C19H28O4/c1-18-11-14(20)13-10-12-7-8-19(13,23-12)15(18)5-6-16(18)22-17-4-2-3-9-21-17/h12-13,15-17H,2-11H2,1H3/t12-,13+,15+,16-,17?,18-,19+/m0/s1
InChIKey NOSIBIFCRYHPNN-GKUABISTSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IR67rXjtQt6
Name (+-)-(1.alpha.,2.alpha.,5.beta.,6.beta.,9.beta.,11.alpha.)-6-methyl-5-tetrahydropyranyloxy-14-oxatetracylo[7,4,1(1,11)0(2,6)]tetradecan-8-one
Alternate Name(s) (1S,2R,5S,6S,9S,11S)-6-methyl-5-(tetrahydro-2H-pyran-2-yloxy)-14-oxatetracyclo[9.2.1.0(1,9).0(2,6)]tetradecan-8-one
CAS Registry Number 101750-74-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-18-11-14(20)13-10-12-7-8-19(13,23-12)15(18)5-6-16(18)22-17-4-2-3-9-21-17/h12-13,15-17H,2-11H2,1H3/t12-,13+,15+,16-,17?,18-,19+/m0/s1
InChIKey NOSIBIFCRYHPNN-GKUABISTSA-N
Molecular Weight 320.429 g/mol
SMILES [C@@]123[C@@](C(=O)C[C@]4([C@]3(CC[C@@]4(OC3OCCCC3)[H])[H])C)(C[C@](O1)([H])CC2)[H]
SPLASH splash10-000i-9002000000-6e468887cf207acbf2ef
Source of Spectrum F-41-4677-20
Wiley ID 1320271