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2-(Allylthio)-1-nitro-2-methylpropane
SpectraBase Compound ID FCeqrpkRu5x
InChI InChI=1S/C7H13NO2S/c1-4-5-11-7(2,3)6-8(9)10/h4H,1,5-6H2,2-3H3
InChIKey SQSBZTYFPOJMQL-UHFFFAOYSA-N
Mol Weight 175.25 g/mol
Molecular Formula C7H13NO2S
Exact Mass 175.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KV7CMTOSlZs
Name 2-(Allylthio)-1-nitro-2-methylpropane
CAS Registry Number 128869-46-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13NO2S
InChI InChI=1S/C7H13NO2S/c1-4-5-11-7(2,3)6-8(9)10/h4H,1,5-6H2,2-3H3
InChIKey SQSBZTYFPOJMQL-UHFFFAOYSA-N
Molecular Weight 175.246 g/mol
SMILES C(C(C)(C)SCC=C)N(=O)=O
SPLASH splash10-00di-9200000000-2bdeedfd1fa24f4c3710
Source of Spectrum J-66-1989-9
Synonyms 2-Allylthio-2-methyl-1-nitropropane 3-[(1,1-dimethyl-2-nitroethyl)sulfanyl]-1-propene Allyl 1,1-dimethyl-2-nitroethyl sulfide
Wiley ID 1534770