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Diethyl 2-(benzo[b]thiophen-3-ylmethyl)-2-butylmalonate
SpectraBase Compound ID 5bKN2Tq3bDc
InChI InChI=1S/C20H26O4S/c1-4-7-12-20(18(21)23-5-2,19(22)24-6-3)13-15-14-25-17-11-9-8-10-16(15)17/h8-11,14H,4-7,12-13H2,1-3H3
InChIKey WTZMQOJPASXYJO-UHFFFAOYSA-N
Mol Weight 362.48 g/mol
Molecular Formula C20H26O4S
Exact Mass 362.15518 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjAmYndhBKS
Name Diethyl 2-(benzo[b]thiophen-3-ylmethyl)-2-butylmalonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O4S
InChI InChI=1S/C20H26O4S/c1-4-7-12-20(18(21)23-5-2,19(22)24-6-3)13-15-14-25-17-11-9-8-10-16(15)17/h8-11,14H,4-7,12-13H2,1-3H3
InChIKey WTZMQOJPASXYJO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200505211
Molecular Weight 362.484 g/mol
SMILES C(C(C(=O)OCC)(Cc1csc2ccccc12)CCCC)(=O)OCC
SPLASH splash10-0002-0911000000-7290551cd527cc3daa65
Source of Spectrum ASC-347-1587/SM14-5i
Wiley ID 1767781