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2-Isopropyl-2-(3'-methyl-5'-benzenesulfonyl-1'-benzyloxy-3'-(Z)-pentenyl)-1,3-dithiane
SpectraBase Compound ID ICa4HH7gk2M
InChI InChI=1S/C26H34O3S3/c1-21(2)26(30-16-10-17-31-26)25(29-20-23-11-6-4-7-12-23)19-22(3)15-18-32(27,28)24-13-8-5-9-14-24/h4-9,11-15,21,25H,10,16-20H2,1-3H3/b22-15-
InChIKey AXNBEBTZMRBZSA-JCMHNJIXSA-N
Mol Weight 490.7 g/mol
Molecular Formula C26H34O3S3
Exact Mass 490.167008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qySelKtv6
Name 2-Isopropyl-2-(3'-methyl-5'-benzenesulfonyl-1'-benzyloxy-3'-(Z)-pentenyl)-1,3-dithiane
Alternate Name(s) (2Z)-5-(benzyloxy)-5-(2-isopropyl-1,3-dithian-2-yl)-3-methyl-2-pentenyl phenyl sulfone 2-[(3Z)-1-(benzyloxy)-3-methyl-5-(phenylsulfonyl)-3-pentenyl]-2-isopropyl-1,3-dithiane 2-[(Z)-5-(benzenesulfonyl)-3-methyl-1-phenylmethoxypent-3-enyl]-2-propan-2-yl-1,3-dithiane 2-[(Z)-5-(benzenesulfonyl)-1-benzyloxy-3-methyl-pent-3-enyl]-2-isopropyl-1,3-dithiane 2-[(Z)-3-methyl-1-phenylmethoxy-5-(phenylsulfonyl)pent-3-enyl]-2-propan-2-yl-1,3-dithiane
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Formula C26H34O3S3
InChI InChI=1S/C26H34O3S3/c1-21(2)26(30-16-10-17-31-26)25(29-20-23-11-6-4-7-12-23)19-22(3)15-18-32(27,28)24-13-8-5-9-14-24/h4-9,11-15,21,25H,10,16-20H2,1-3H3/b22-15-
InChIKey AXNBEBTZMRBZSA-JCMHNJIXSA-N
Molecular Weight 490.735 g/mol
SMILES C(S(=O)(=O)c1ccccc1)\C=C/(CC(C1(SCCCS1)C(C)C)OCc1ccccc1)C
SPLASH splash10-01r6-6906000000-83491fc201592bdcdb38
Source of Spectrum OP-26-453-18
Wiley ID 850571