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(Z)-4-(3-Cyclohexyl-1-tosyl-1H-indol-2-yl)but-3-en-2-one
SpectraBase Compound ID 5EzH1Dlzacd
InChI InChI=1S/C25H27NO3S/c1-18-12-15-21(16-13-18)30(28,29)26-23-11-7-6-10-22(23)25(20-8-4-3-5-9-20)24(26)17-14-19(2)27/h6-7,10-17,20H,3-5,8-9H2,1-2H3/b17-14-
InChIKey YDTCMJKXMJRXDJ-VKAVYKQESA-N
Mol Weight 421.56 g/mol
Molecular Formula C25H27NO3S
Exact Mass 421.171165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmrGd9HFTPv
Name (Z)-4-(3-Cyclohexyl-1-tosyl-1H-indol-2-yl)but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27NO3S
InChI InChI=1S/C25H27NO3S/c1-18-12-15-21(16-13-18)30(28,29)26-23-11-7-6-10-22(23)25(20-8-4-3-5-9-20)24(26)17-14-19(2)27/h6-7,10-17,20H,3-5,8-9H2,1-2H3/b17-14-
InChIKey YDTCMJKXMJRXDJ-VKAVYKQESA-N
Literature Reference DOI 10.1021/acs.orglett.6b00805
Molecular Weight 421.555 g/mol
SMILES c1([n](c2ccccc2c1C1CCCCC1)S(=O)(=O)c1ccc(C)cc1)\C=C/C(C)=O
SPLASH splash10-00ku-9537100000-f3ab6e47be6979688670
Source of Spectrum A1-18-2192/SM20-2i
Wiley ID 1805420