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(1R,2R)-8-Methoxy-1-pentyl-2-(phenylthio)-1,2,3,4-tetrahydronaphthalene
SpectraBase Compound ID 6uvJp5czWnj
InChI InChI=1S/C22H28OS/c1-3-4-6-13-19-21(24-18-11-7-5-8-12-18)16-15-17-10-9-14-20(23-2)22(17)19/h5,7-12,14,19,21H,3-4,6,13,15-16H2,1-2H3/t19-,21+/m0/s1
InChIKey XWPUGXWOGCJLOZ-PZJWPPBQSA-N
Mol Weight 340.53 g/mol
Molecular Formula C22H28OS
Exact Mass 340.186087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1j3dpvOa0w9
Name (1R,2R)-8-Methoxy-1-pentyl-2-(phenylthio)-1,2,3,4-tetrahydronaphthalene
Alternate Name(s) ((1R,2R)-8-methoxy-1-pentyl-1,2,3,4-tetrahydronaphthalen-2-yl)(phenyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28OS
InChI InChI=1S/C22H28OS/c1-3-4-6-13-19-21(24-18-11-7-5-8-12-18)16-15-17-10-9-14-20(23-2)22(17)19/h5,7-12,14,19,21H,3-4,6,13,15-16H2,1-2H3/t19-,21+/m0/s1
InChIKey XWPUGXWOGCJLOZ-PZJWPPBQSA-N
Literature Reference DOI 10.1021/jo4023765
Molecular Weight 340.525 g/mol
SMILES [C@@]1(c2c(cccc2OC)CC[C@]1(Sc1ccccc1)[H])(CCCCC)[H]
SPLASH splash10-06sj-3911000000-a8035e84b27bce67de5b
Source of Spectrum J-79-167-trans_30
Wiley ID 1745929