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2-Thiophenepentanoic acid, 2,5-dihydro-, methyl ester, 1,1-dioxide
SpectraBase Compound ID CRNwhXoE4Y7
InChI InChI=1S/C10H16O4S/c1-14-10(11)7-3-2-5-9-6-4-8-15(9,12)13/h4,6,9H,2-3,5,7-8H2,1H3
InChIKey VJCLTNUQUGKQGJ-UHFFFAOYSA-N
Mol Weight 232.29 g/mol
Molecular Formula C10H16O4S
Exact Mass 232.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jdb8v8HfPvy
Name 2-Thiophenepentanoic acid, 2,5-dihydro-, methyl ester, 1,1-dioxide
CAS Registry Number 87879-67-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O4S
InChI InChI=1S/C10H16O4S/c1-14-10(11)7-3-2-5-9-6-4-8-15(9,12)13/h4,6,9H,2-3,5,7-8H2,1H3
InChIKey VJCLTNUQUGKQGJ-UHFFFAOYSA-N
Molecular Weight 232.294 g/mol
SMILES C1(S(CC=C1)(=O)=O)CCCCC(=O)OC
SPLASH splash10-00kf-9200000000-0f34d48192a6c12b8e34
Source of Spectrum KC-1983-1934-0
Synonyms Methyl 5-(1,1-dioxido-2,5-dihydro-2-thienyl)pentanoate Methyl 5-(2,5-dihydro-2-thienyl)pentanoate 1,1-dioxide
Wiley ID 1233322