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6-[5-(6-oxidanyl-6-oxidanylidene-hexyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid
SpectraBase Compound ID G0D3n7pTQfy
InChI InChI=1S/C15H26N2O4S2/c18-13(19)7-3-1-5-9-16-11-17(15(22)23-12-16)10-6-2-4-8-14(20)21/h1-12H2,(H,18,19)(H,20,21)
InChIKey XUGZSEQNLLRCQK-UHFFFAOYSA-N
Mol Weight 362.5 g/mol
Molecular Formula C15H26N2O4S2
Exact Mass 362.1334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EmOLlSjKM6o
Name 6-[5-(6-oxidanyl-6-oxidanylidene-hexyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26N2O4S2
InChI InChI=1S/C15H26N2O4S2/c18-13(19)7-3-1-5-9-16-11-17(15(22)23-12-16)10-6-2-4-8-14(20)21/h1-12H2,(H,18,19)(H,20,21)
InChIKey XUGZSEQNLLRCQK-UHFFFAOYSA-N
Molecular Weight 362.503 g/mol
SMILES OC(CCCCCN1CSC(N(CCCCCC(=O)O)C1)=S)=O
SPLASH splash10-004i-9500000000-06a437d2986f05bdddc5
Source of Spectrum AT-41-616-5
Synonyms 6-[5-(5-carboxypentyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid
Wiley ID 854742