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1-Nitro-4-(propylsulfonyl)benzene
SpectraBase Compound ID EDh5yccTMiK
InChI InChI=1S/C9H11NO4S/c1-2-7-15(13,14)9-5-3-8(4-6-9)10(11)12/h3-6H,2,7H2,1H3
InChIKey CHAQFGDMQHQHMK-UHFFFAOYSA-N
Mol Weight 229.25 g/mol
Molecular Formula C9H11NO4S
Exact Mass 229.040879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Joh3DVDQAs9
Name 1-Nitro-4-(propylsulfonyl)benzene
Alternate Name(s) 4-Nitrophenyl propyl sulfone Benzene, 1-nitro-4-propylsulfonyl- 1-Nitro-4-propylsulfonylbenzene
CAS Registry Number 119871-14-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO4S
InChI InChI=1S/C9H11NO4S/c1-2-7-15(13,14)9-5-3-8(4-6-9)10(11)12/h3-6H,2,7H2,1H3
InChIKey CHAQFGDMQHQHMK-UHFFFAOYSA-N
Molecular Weight 229.250 g/mol
SMILES CCCS(c1ccc(N(=O)=O)cc1)(=O)=O
SPLASH splash10-0006-9100000000-261b0979adaf0d8ec88c
Source of Spectrum AD-0-2532-0
Wiley ID 1427996