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5-(7-Isopropyl-10-methyl-5-oxo-1,5-dithia-spiro[5.5]undec-2-yl)-pentanoic acid
SpectraBase Compound ID 58oLdW48ST0
InChI InChI=1S/C18H32O3S2/c1-13(2)16-9-8-14(3)12-18(16)22-15(10-11-23(18)21)6-4-5-7-17(19)20/h13-16H,4-12H2,1-3H3,(H,19,20)
InChIKey GQKPPCCEAREUDS-UHFFFAOYSA-N
Mol Weight 360.6 g/mol
Molecular Formula C18H32O3S2
Exact Mass 360.179287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IRpxsmolM
Name 5-(7-Isopropyl-10-methyl-5-oxo-1,5-dithia-spiro[5.5]undec-2-yl)-pentanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H32O3S2
InChI InChI=1S/C18H32O3S2/c1-13(2)16-9-8-14(3)12-18(16)22-15(10-11-23(18)21)6-4-5-7-17(19)20/h13-16H,4-12H2,1-3H3,(H,19,20)
InChIKey GQKPPCCEAREUDS-UHFFFAOYSA-N
Molecular Weight 360.571 g/mol
SMILES OC(CCCCC1CCS(C2(CC(CCC2C(C)C)C)S1)=O)=O
SPLASH splash10-00lg-9500000000-37c15a6640e2ad0955b0
Synonyms 5-(7-Isopropyl-10-methyl-5-oxido-1,5-dithiaspiro[5.5]undec-2-yl)pentanoic acid 5-(8-Methyl-5-oxo-11-propan-2-yl-1,5$l^{4}-dithiaspiro[5.5]undecan-2-yl)pentanoic acid 5-(11-isopropyl-8-methyl-5-oxo-1,5$l^{4}-dithiaspiro[5.5]undecan-2-yl)pentanoic acid 5-(8-Methyl-5-oxidanylidene-11-propan-2-yl-1,5$l^{4}-dithiaspiro[5.5]undecan-2-yl)pentanoic acid
Wiley ID 1485666