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1,3-Benzodioxole-5-methanol, .alpha.-[2-(1,3-benzodioxol-5-yl)-1,3-dithian-2-yl]-6-[2-(dimethylami no)ethyl]-
SpectraBase Compound ID 4ISBon68eus
InChI InChI=1S/C23H27NO5S2/c1-24(2)7-6-15-10-19-21(29-14-27-19)12-17(15)22(25)23(30-8-3-9-31-23)16-4-5-18-20(11-16)28-13-26-18/h4-5,10-12,22,25H,3,6-9,13-14H2,1-2H3
InChIKey RAFFYTALAMMOSB-UHFFFAOYSA-N
Mol Weight 461.59 g/mol
Molecular Formula C23H27NO5S2
Exact Mass 461.133065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RyFMNqBqLA
Name 1,3-Benzodioxole-5-methanol, .alpha.-[2-(1,3-benzodioxol-5-yl)-1,3-dithian-2-yl]-6-[2-(dimethylami no)ethyl]-
CAS Registry Number 102327-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27NO5S2
InChI InChI=1S/C23H27NO5S2/c1-24(2)7-6-15-10-19-21(29-14-27-19)12-17(15)22(25)23(30-8-3-9-31-23)16-4-5-18-20(11-16)28-13-26-18/h4-5,10-12,22,25H,3,6-9,13-14H2,1-2H3
InChIKey RAFFYTALAMMOSB-UHFFFAOYSA-N
Molecular Weight 461.591 g/mol
SMILES OC(c1cc2OCOc2cc1CCN(C)C)C1(c2cc3OCOc3cc2)SCCCS1
SPLASH splash10-0a4i-9030000000-d0540dbd1581d4b0f4a7
Source of Spectrum F-41-2887-0
Synonyms 1,3-Dithiane, 1,3-benzodioxole-5-methanol deriv. 2-Hydroxy-2-(2-[.beta.-(N,N-dimethyl)aminoethyl]-4,5-methylenedioxyphenyl)-1-(3,4-methylenedioxyphenyl)-ethanone 1,3-propylenedithioacetal [2-(1,3-benzodioxol-5-yl)-1,3-dithian-2-yl]{6-[2-(dimethylamino)ethyl]-1,3-benzodioxol-5-yl}methanol
Wiley ID 1390757