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7,7'-Bis(hydroxymethyl)-5,5'-bis(1,1-dimethylethyl)-3,3,3',3'-tetramethyl-1,1'- spirobi[3H-2,1-benzoxathiole]
SpectraBase Compound ID Jxm7KOghQgG
InChI InChI=1S/C28H40O4S/c1-25(2,3)19-11-17(15-29)23-21(13-19)27(7,8)31-33(23)24-18(16-30)12-20(26(4,5)6)14-22(24)28(9,10)32-33/h11-14,29-30H,15-16H2,1-10H3
InChIKey APQSBYAWLORBLD-UHFFFAOYSA-N
Mol Weight 472.7 g/mol
Molecular Formula C28H40O4S
Exact Mass 472.264731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEsy92FHwTH
Name 7,7'-Bis(hydroxymethyl)-5,5'-bis(1,1-dimethylethyl)-3,3,3',3'-tetramethyl-1,1'- spirobi[3H-2,1-benzoxathiole]
CAS Registry Number 78479-67-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H40O4S
InChI InChI=1S/C28H40O4S/c1-25(2,3)19-11-17(15-29)23-21(13-19)27(7,8)31-33(23)24-18(16-30)12-20(26(4,5)6)14-22(24)28(9,10)32-33/h11-14,29-30H,15-16H2,1-10H3
InChIKey APQSBYAWLORBLD-UHFFFAOYSA-N
Molecular Weight 472.684 g/mol
SMILES OCc1cc(cc2c1S1(c3c(CO)cc(cc3C(O1)(C)C)C(C)(C)C)OC2(C)C)C(C)(C)C
SPLASH splash10-0a4i-0040900000-53f32347d7758dbd02a2
Source of Spectrum J-46-4463-0
Synonyms 5,5'-di-tert-butyl-7'-(hydroxymethyl)-3,3,3',3'-tetramethyl-3H,3'H-1-1,1'-spirobi[[2,1]benzoxathiole]-7-ylmethanol
Wiley ID 1393426