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2,2-Dimethyl-1-(5'-nitro-2'-furyl)propyl p-tolyl sulfide
SpectraBase Compound ID EQ5a50lNOjq
InChI InChI=1S/C16H19NO3S/c1-11-5-7-12(8-6-11)21-15(16(2,3)4)13-9-10-14(20-13)17(18)19/h5-10,15H,1-4H3
InChIKey WCVYJJXIXZKRCD-UHFFFAOYSA-N
Mol Weight 305.39 g/mol
Molecular Formula C16H19NO3S
Exact Mass 305.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMgd9NgHIc9
Name 2,2-Dimethyl-1-(5'-nitro-2'-furyl)propyl p-tolyl sulfide
CAS Registry Number 108344-59-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO3S
InChI InChI=1S/C16H19NO3S/c1-11-5-7-12(8-6-11)21-15(16(2,3)4)13-9-10-14(20-13)17(18)19/h5-10,15H,1-4H3
InChIKey WCVYJJXIXZKRCD-UHFFFAOYSA-N
Molecular Weight 305.392 g/mol
SMILES c1(N(=O)=O)oc(C(Sc2ccc(cc2)C)C(C)(C)C)cc1
SPLASH splash10-0a59-9771000000-b8fa15c9d96143cf4acb
Source of Spectrum J-52-2799-17
Synonyms 2,2-Dimethyl-1-(5'-niro-2'-furyl)propyl p-tilyl sulfide 2,2-Dimethyl-1-(5-nitro-2-furyl)propyl 4-methylphenyl sulfide 2-{2,2-dimethyl-1-[(4-methylphenyl)sulfanyl]propyl}-5-nitrofuran
Wiley ID 1307260