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t-Butyl 3-methyl-4-phenylthiohept-2(Z)-enoate
SpectraBase Compound ID 9TGHOPMEN7Y
InChI InChI=1S/C18H26O2S/c1-6-10-16(21-15-11-8-7-9-12-15)14(2)13-17(19)20-18(3,4)5/h7-9,11-13,16H,6,10H2,1-5H3/b14-13-
InChIKey QZUGYZZFXFPGOV-YPKPFQOOSA-N
Mol Weight 306.46 g/mol
Molecular Formula C18H26O2S
Exact Mass 306.165351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RikLXb5v1c
Name t-Butyl 3-methyl-4-phenylthiohept-2(Z)-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O2S
InChI InChI=1S/C18H26O2S/c1-6-10-16(21-15-11-8-7-9-12-15)14(2)13-17(19)20-18(3,4)5/h7-9,11-13,16H,6,10H2,1-5H3/b14-13-
InChIKey QZUGYZZFXFPGOV-YPKPFQOOSA-N
Molecular Weight 306.464 g/mol
SMILES C(\C=C/(C(Sc1ccccc1)CCC)C)(OC(C)(C)C)=O
SPLASH splash10-0a4m-9610000000-8645493c4cc1ec2dbb33
Source of Spectrum QF-48-1378-7
Synonyms tert-Butyl (2Z)-3-methyl-4-(phenylsulfanyl)-2-heptenoate (Z)-3-methyl-4-(phenylthio)-2-heptenoic acid tert-butyl ester tert-Butyl (Z)-3-methyl-4-phenylsulfanylhept-2-enoate tert-Butyl (Z)-3-methyl-4-phenylsulfanyl-hept-2-enoate
Wiley ID 833974