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6-(1,1-Dimethylethyl)-4-methyl-3-(phenylthio)cyclohex-4-ene-1,2-dicarboxylic anhydride
SpectraBase Compound ID 9gXzKqWHl0B
InChI InChI=1S/C19H22O3S/c1-11-10-13(19(2,3)4)14-15(18(21)22-17(14)20)16(11)23-12-8-6-5-7-9-12/h5-10,13-16H,1-4H3
InChIKey VQFUMUCVMYFITN-UHFFFAOYSA-N
Mol Weight 330.44 g/mol
Molecular Formula C19H22O3S
Exact Mass 330.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPSiOBw24C5
Name 6-(1,1-Dimethylethyl)-4-methyl-3-(phenylthio)cyclohex-4-ene-1,2-dicarboxylic anhydride
Alternate Name(s) 7-tert-Butyl-5-methyl-4-(phenylsulfanyl)-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O3S
InChI InChI=1S/C19H22O3S/c1-11-10-13(19(2,3)4)14-15(18(21)22-17(14)20)16(11)23-12-8-6-5-7-9-12/h5-10,13-16H,1-4H3
InChIKey VQFUMUCVMYFITN-UHFFFAOYSA-N
Molecular Weight 330.442 g/mol
SMILES C12C(OC(C2C(C(C)(C)C)C=C(C1Sc1ccccc1)C)=O)=O
SPLASH splash10-0bt9-9601000000-d7de4a113b024338c6ff
Source of Spectrum J-61-5303-25
Wiley ID 1327913