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

*Links on SpectraBase are not permalinks.
(2'R,3'aR,7'aS)-1'-hex-5-enyl-2'-spiro[1,3-dithiane-2,7'-3,3a,4,5,6,7a-hexahydro-2H-indole]carboxylic acid ethyl ester
SpectraBase Compound ID KFamvpfLkja
InChI InChI=1S/C20H33NO2S2/c1-3-5-6-7-12-21-17(19(22)23-4-2)15-16-10-8-11-20(18(16)21)24-13-9-14-25-20/h3,16-18H,1,4-15H2,2H3/t16-,17-,18+/m1/s1
InChIKey QOHAJMUKNODJEB-KURKYZTESA-N
Mol Weight 383.6 g/mol
Molecular Formula C20H33NO2S2
Exact Mass 383.195272 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 3mkM8smd0nK
Name (2'R,3'aR,7'aS)-1'-hex-5-enyl-2'-spiro[1,3-dithiane-2,7'-3,3a,4,5,6,7a-hexahydro-2H-indole]carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H33NO2S2
InChI InChI=1S/C20H33NO2S2/c1-3-5-6-7-12-21-17(19(22)23-4-2)15-16-10-8-11-20(18(16)21)24-13-9-14-25-20/h3,16-18H,1,4-15H2,2H3/t16-,17-,18+/m1/s1
InChIKey QOHAJMUKNODJEB-KURKYZTESA-N
Molecular Weight 383.609 g/mol
SMILES [C@@]1(N([C@]2([C@@](C1)(CCCC21SCCCS1)[H])[H])CCCCC=C)(C(=O)OCC)[H]
SPLASH splash10-0f79-0509000000-e403f67abf1ee0576c9d
Source of Spectrum K-2001-1762-16
Synonyms (2'R,3'aR,7'aS)-1'-hex-5-enylspiro[1,3-dithiane-2,7'-3,3a,4,5,6,7a-hexahydro-2H-indole]-2'-carboxylic acid ethyl ester Ethyl (2'R,3'aR,7'aS)-1'-hex-5-enylspiro[1,3-dithiane-2,7'-3,3a,4,5,6,7a-hexahydro-2H-indole]-2'-carboxylate
Wiley ID 1579310