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((5R,6R)-5-(3-Chloropropyl)-6-(phenylthio)-5,6,7,8-tetrahydronaphtho[2,3-d]-1,3-dioxole

View entire compound with spectra: 1 MS (GC)

((5R,6R)-5-(3-Chloropropyl)-6-(phenylthio)-5,6,7,8-tetrahydronaphtho[2,3-d]-1,3-dioxole
SpectraBase Compound ID Gfm1cXf5cMf
InChI InChI=1S/C20H21ClO2S/c21-10-4-7-16-17-12-19-18(22-13-23-19)11-14(17)8-9-20(16)24-15-5-2-1-3-6-15/h1-3,5-6,11-12,16,20H,4,7-10,13H2/t16-,20-/m1/s1
InChIKey CIDJFJXPGUGTRR-OXQOHEQNSA-N
Mol Weight 360.9 g/mol
Molecular Formula C20H21ClO2S
Exact Mass 360.095079 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5KgSompRVvK
Name ((5R,6R)-5-(3-Chloropropyl)-6-(phenylthio)-5,6,7,8-tetrahydronaphtho[2,3-d]-1,3-dioxole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21ClO2S
InChI InChI=1S/C20H21ClO2S/c21-10-4-7-16-17-12-19-18(22-13-23-19)11-14(17)8-9-20(16)24-15-5-2-1-3-6-15/h1-3,5-6,11-12,16,20H,4,7-10,13H2/t16-,20-/m1/s1
InChIKey CIDJFJXPGUGTRR-OXQOHEQNSA-N
Literature Reference DOI 10.1021/jo4023765
Molecular Weight 360.899 g/mol
SMILES [C@@]1(c2c(CC[C@]1(Sc1ccccc1)[H])cc1OCOc1c2)(CCCCl)[H]
SPLASH splash10-0w90-0942000000-69a5460de2a477f3fd87
Source of Spectrum J-79-166-trans_14o
Synonyms (5R,6R)-5-(3-chloropropyl)-6-(phenylthio)-5,6,7,8-tetrahydronaphtho[2,3-d][1,3]dioxole
Wiley ID 1745926