For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(E,4R,7R,8R)-13-benzoxy-7-(methoxymethoxy)-4,6,8-trimethyl-tridec-5-en-9-yn-2-one
SpectraBase Compound ID 9M8OO4fSeAq
InChI InChI=1S/C25H36O4/c1-20(17-23(4)26)16-22(3)25(29-19-27-5)21(2)12-8-7-11-15-28-18-24-13-9-6-10-14-24/h6,9-10,13-14,16,20-21,25H,7,11,15,17-19H2,1-5H3/b22-16+/t20-,21+,25+/m0/s1
InChIKey OPBSYOJZUOSVNP-HDOBTFFZSA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID D708VAGfogG
Name (E,4R,7R,8R)-13-benzoxy-7-(methoxymethoxy)-4,6,8-trimethyl-tridec-5-en-9-yn-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-20(17-23(4)26)16-22(3)25(29-19-27-5)21(2)12-8-7-11-15-28-18-24-13-9-6-10-14-24/h6,9-10,13-14,16,20-21,25H,7,11,15,17-19H2,1-5H3/b22-16+/t20-,21+,25+/m0/s1
InChIKey OPBSYOJZUOSVNP-HDOBTFFZSA-N
Molecular Weight 400.559 g/mol
SMILES [C@@](\C=C\([C@@]([C@@](C#CCCCOCc1ccccc1)(C)[H])(OCOC)[H])C)(CC(=O)C)(C)[H]
SPLASH splash10-0002-2900000000-47302dabb3b6ad6202dc
Source of Spectrum F-69-4645-45
Synonyms (E,4R,7R,8R)-13-benzyloxy-7-(methoxymethoxy)-4,6,8-trimethyl-tridec-5-en-9-yn-2-one (E,4R,7R,8R)-7-(methoxymethoxy)-4,6,8-trimethyl-13-phenylmethoxy-2-tridec-5-en-9-ynone (E,4R,7R,8R)-7-(methoxymethoxy)-4,6,8-trimethyl-13-phenylmethoxy-tridec-5-en-9-yn-2-one
Wiley ID 1595237