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2-Propenimidothioic acid, 3-(dimethylamino)-3-ethoxy-N-(methylsulfonyl)-, methyl ester
SpectraBase Compound ID 3WvCfWE3WuB
InChI InChI=1S/C9H18N2O3S2/c1-6-14-9(11(2)3)7-8(15-4)10-16(5,12)13/h7H,6H2,1-5H3/b9-7+,10-8-
InChIKey NYAAISOKUWJQIG-ZWOQCJTASA-N
Mol Weight 266.37 g/mol
Molecular Formula C9H18N2O3S2
Exact Mass 266.075885 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHKvK2ixuDO
Name 2-Propenimidothioic acid, 3-(dimethylamino)-3-ethoxy-N-(methylsulfonyl)-, methyl ester
CAS Registry Number 100419-20-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18N2O3S2
InChI InChI=1S/C9H18N2O3S2/c1-6-14-9(11(2)3)7-8(15-4)10-16(5,12)13/h7H,6H2,1-5H3/b9-7+,10-8-
InChIKey NYAAISOKUWJQIG-ZWOQCJTASA-N
Molecular Weight 266.374 g/mol
SMILES CN(\C(=C/C(=N/S(=O)(=O)C)SC)OCC)C
SPLASH splash10-014m-9070000000-8072f94648b4bddbfb14
Source of Spectrum K-118-3225-10
Synonyms N-[(Z,2E)-3-(dimethylamino)-3-ethoxy-1-(methylsulfanyl)-2-propenylidene]methanesulfonamide N-[3-(dimethylamino)-3-ethoxy-1-(methylthio)-2-propenyliden]methansulfonamind
Wiley ID 1269381