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5-Butyl-5,6,7,8,9,10-hexahydro-5,9-epithiocycloocta[f]-(1,3)benzodioxole
SpectraBase Compound ID 7mjiwUwSM26
InChI InChI=1S/C17H22O2S/c1-2-3-6-17-7-4-5-13(20-17)8-12-9-15-16(10-14(12)17)19-11-18-15/h9-10,13H,2-8,11H2,1H3
InChIKey XMXIZBARPCJLAV-UHFFFAOYSA-N
Mol Weight 290.42 g/mol
Molecular Formula C17H22O2S
Exact Mass 290.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUd2F4UHgRd
Name 5-Butyl-5,6,7,8,9,10-hexahydro-5,9-epithiocycloocta[f]-(1,3)benzodioxole
Alternate Name(s) 1-Butyl-5,7-dioxa-16-thiatetracyclo[10.3.1.0(2,10).0(4,8)]hexadeca-2(10),3,8-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O2S
InChI InChI=1S/C17H22O2S/c1-2-3-6-17-7-4-5-13(20-17)8-12-9-15-16(10-14(12)17)19-11-18-15/h9-10,13H,2-8,11H2,1H3
InChIKey XMXIZBARPCJLAV-UHFFFAOYSA-N
Molecular Weight 290.421 g/mol
SMILES C12(c3c(cc4c(c3)OCO4)CC(S2)CCC1)CCCC
SPLASH splash10-0abm-9020000000-e334d409d13d1ce7c457
Source of Spectrum H-84-171-15
Wiley ID 847418