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Benzenemethanol, .alpha.,.alpha.-dimethyl-2-[(4-nitrophenyl)sulfinyl]-
SpectraBase Compound ID CitI62kFJib
InChI InChI=1S/C15H15NO4S/c1-15(2,17)13-10-11(16(18)19)8-9-14(13)21(20)12-6-4-3-5-7-12/h3-10,17H,1-2H3
InChIKey UYUMRRKHGHOXDL-UHFFFAOYSA-N
Mol Weight 305.35 g/mol
Molecular Formula C15H15NO4S
Exact Mass 305.072179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jTEgI5ezif
Name Benzenemethanol, .alpha.,.alpha.-dimethyl-2-[(4-nitrophenyl)sulfinyl]-
CAS Registry Number 62172-69-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO4S
InChI InChI=1S/C15H15NO4S/c1-15(2,17)13-10-11(16(18)19)8-9-14(13)21(20)12-6-4-3-5-7-12/h3-10,17H,1-2H3
InChIKey UYUMRRKHGHOXDL-UHFFFAOYSA-N
Molecular Weight 305.348 g/mol
SMILES OC(c1c(S(=O)c2ccccc2)ccc(N(=O)=O)c1)(C)C
SPLASH splash10-0006-4390000000-cc281e7f19cb0ce7ce10
Source of Spectrum C-99-153-0
Synonyms 2-(2-Hydroxy-2-propyl)-4-nitro-1-phenylsulfinylbenzene 2-[5-nitro-2-(phenylsulfinyl)phenyl]-2-propanol
Wiley ID 1307200