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3,4-Dihydro-6-[3'-hydroxy-1'-(para-toluenesulfonyl)-1'-butyl]-2H-pyran
SpectraBase Compound ID KVq95u2iJJP
InChI InChI=1S/C16H22O4S/c1-12-6-8-14(9-7-12)21(18,19)16(11-13(2)17)15-5-3-4-10-20-15/h5-9,13,16-17H,3-4,10-11H2,1-2H3
InChIKey FNCDEEMVTONWFX-UHFFFAOYSA-N
Mol Weight 310.41 g/mol
Molecular Formula C16H22O4S
Exact Mass 310.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9O9P4FWseo3
Name 3,4-Dihydro-6-[3'-hydroxy-1'-(para-toluenesulfonyl)-1'-butyl]-2H-pyran
Alternate Name(s) 4-(3,4-dihydro-2H-pyran-6-yl)-4-[(4-methylphenyl)sulfonyl]-2-butanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4S
InChI InChI=1S/C16H22O4S/c1-12-6-8-14(9-7-12)21(18,19)16(11-13(2)17)15-5-3-4-10-20-15/h5-9,13,16-17H,3-4,10-11H2,1-2H3
InChIKey FNCDEEMVTONWFX-UHFFFAOYSA-N
Molecular Weight 310.408 g/mol
SMILES OC(CC(S(c1ccc(cc1)C)(=O)=O)C=1OCCCC1)C
SPLASH splash10-052f-9400000000-b72106a06bf5105da3fe
Source of Spectrum F-57-568-13
Wiley ID 1549337