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2H,18H-5,8,11,14,17,1-Benzopentaoxathiacycloeicosin, 3,4,6,7,9,10,12,13,15,16-decahydro-
SpectraBase Compound ID 1pJaFVOrQ5w
InChI InChI=1S/C18H28O5S/c1-2-6-18-17(5-4-16-24-18)23-15-14-22-13-12-21-11-10-20-9-8-19-7-3-1/h1-3,6H,4-5,7-16H2/b3-1-,6-2-
InChIKey YGYMUEYHPRSAFT-SJDXMKNESA-N
Mol Weight 356.48 g/mol
Molecular Formula C18H28O5S
Exact Mass 356.165745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bv3wIY7OYoN
Name 2H,18H-5,8,11,14,17,1-Benzopentaoxathiacycloeicosin, 3,4,6,7,9,10,12,13,15,16-decahydro-
CAS Registry Number 122476-15-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O5S
InChI InChI=1S/C18H28O5S/c1-2-6-18-17(5-4-16-24-18)23-15-14-22-13-12-21-11-10-20-9-8-19-7-3-1/h1-3,6H,4-5,7-16H2/b3-1-,6-2-
InChIKey YGYMUEYHPRSAFT-SJDXMKNESA-N
Molecular Weight 356.477 g/mol
SMILES C12=C(OCCOCCOCCOCCOC\C=C/C=C\2)CCCS1
SPLASH splash10-000b-9300000000-fbaf05f79da82def5a15
Source of Spectrum B-41-1952-16
Synonyms 2,3,5,6,8,9,11,12,14,20,21,22-dodecahydrothiino[3,2-n][1,4,7,10,13]pentaoxacycloicosin 3,4,6,7,9,10,12,13,15,16-Decahydro-2H,18H-5,8,11,14,17,1-pentaoxathiabenzocycloeicosin
Wiley ID 1345679