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

*Links on SpectraBase are not permalinks.
(4R,5S,6S)-2-(1,3-dithian-2-yl)-2,4,6-trimethyl-5-oxidanyl-undec-10-yn-3-one
SpectraBase Compound ID HI3NKDmw3xi
InChI InChI=1S/C18H30O2S2/c1-6-7-8-10-13(2)15(19)14(3)16(20)18(4,5)17-21-11-9-12-22-17/h1,13-15,17,19H,7-12H2,2-5H3/t13-,14+,15-/m0/s1
InChIKey HVPHHDZWWWAXKL-ZNMIVQPWSA-N
Mol Weight 342.56 g/mol
Molecular Formula C18H30O2S2
Exact Mass 342.168723 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 G4HAsogSDvN
Name (4R,5S,6S)-2-(1,3-dithian-2-yl)-2,4,6-trimethyl-5-oxidanyl-undec-10-yn-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O2S2
InChI InChI=1S/C18H30O2S2/c1-6-7-8-10-13(2)15(19)14(3)16(20)18(4,5)17-21-11-9-12-22-17/h1,13-15,17,19H,7-12H2,2-5H3/t13-,14+,15-/m0/s1
InChIKey HVPHHDZWWWAXKL-ZNMIVQPWSA-N
Molecular Weight 342.556 g/mol
SMILES O[C@]([C@](C(C(C1SCCCS1)(C)C)=O)(C)[H])([C@](CCCC#C)(C)[H])[H]
SPLASH splash10-014i-0900000000-63e21ba07a4be1ec15fe
Source of Spectrum D1-1997-1383-13
Synonyms (4R,5S,6S)-2-(1,3-dithian-2-yl)-5-hydroxy-2,4,6-trimethyl-10-undecyn-3-one (4R,5S,6S)-2-(1,3-dithian-2-yl)-5-hydroxy-2,4,6-trimethyl-undec-10-yn-3-one
Wiley ID 834968