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

*Links on SpectraBase are not permalinks.
(3S,4S,5R)-5-Acetoxy-3,4-isopropylidenedioxy-2-methylthio-3,4,5,6-tetrahydropyridine
SpectraBase Compound ID LDp5sLStVHi
InChI InChI=1S/C11H17NO4S/c1-6(13)14-7-5-12-10(17-4)9-8(7)15-11(2,3)16-9/h7-9H,5H2,1-4H3/t7-,8+,9+/m1/s1
InChIKey XDNOXKOOMYBLGU-VGMNWLOBSA-N
Mol Weight 259.32 g/mol
Molecular Formula C11H17NO4S
Exact Mass 259.087829 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 4iBdwnh9M9L
Name (3S,4S,5R)-5-Acetoxy-3,4-isopropylidenedioxy-2-methylthio-3,4,5,6-tetrahydropyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17NO4S
InChI InChI=1S/C11H17NO4S/c1-6(13)14-7-5-12-10(17-4)9-8(7)15-11(2,3)16-9/h7-9H,5H2,1-4H3/t7-,8+,9+/m1/s1
InChIKey XDNOXKOOMYBLGU-VGMNWLOBSA-N
Molecular Weight 259.320 g/mol
SMILES [C@@]12([C@@](OC(O2)(C)C)([C@](OC(=O)C)(CN=C1SC)[H])[H])[H]
SPLASH splash10-002p-0910000000-bf46bafe8a5de0821bae
Source of Spectrum F-66-8185-7
Synonyms Acetic acid (3aS,7R,7aS)-2,2-dimethyl-4-methylsulfanyl-3a,6,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyridin-7-yl ester
Wiley ID 1684548