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3,3-Dimethyl-2,4-dihydro-6,8-dineopentylbenzo[b]thiapyran
SpectraBase Compound ID 7n4RECZ1L52
InChI InChI=1S/C21H34S/c1-19(2,3)11-15-9-16(12-20(4,5)6)18-17(10-15)13-21(7,8)14-22-18/h9-10H,11-14H2,1-8H3
InChIKey RHBLEIABFLVALN-UHFFFAOYSA-N
Mol Weight 318.6 g/mol
Molecular Formula C21H34S
Exact Mass 318.238122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BopMY1Z9bj
Name 3,3-Dimethyl-2,4-dihydro-6,8-dineopentylbenzo[b]thiapyran
CAS Registry Number 86563-39-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34S
InChI InChI=1S/C21H34S/c1-19(2,3)11-15-9-16(12-20(4,5)6)18-17(10-15)13-21(7,8)14-22-18/h9-10H,11-14H2,1-8H3
InChIKey RHBLEIABFLVALN-UHFFFAOYSA-N
Molecular Weight 318.563 g/mol
SMILES c12SCC(Cc2cc(cc1CC(C)(C)C)CC(C)(C)C)(C)C
SPLASH splash10-03di-0192000000-5abacaf3153a0184cf3c
Source of Spectrum J-48-3073-0
Synonyms 3,3-Dimethyl-4,4-dihydro-6,8-dineiopentylbenzo[b]thiapyran 3,3-Dimethyl-6,8-dineopentyl-3,4-dihydro-2H-1-benzothiopyran
Wiley ID 1319030