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1-[(4-Azidobutyl)sulfinyl]-4-methylbenzene
SpectraBase Compound ID VgwRe27yUP
InChI InChI=1S/C11H15N3OS/c1-10-4-6-11(7-5-10)16(15)9-3-2-8-13-14-12/h4-7H,2-3,8-9H2,1H3
InChIKey ROSNWUZUJLKHCX-UHFFFAOYSA-N
Mol Weight 237.32 g/mol
Molecular Formula C11H15N3OS
Exact Mass 237.093583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hp6qN3x4yXx
Name 1-[(4-Azidobutyl)sulfinyl]-4-methylbenzene
Appearance Light yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15N3OS
InChI InChI=1S/C11H15N3OS/c1-10-4-6-11(7-5-10)16(15)9-3-2-8-13-14-12/h4-7H,2-3,8-9H2,1H3
InChIKey ROSNWUZUJLKHCX-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804284
Molecular Weight 237.321 g/mol
Quality 68
SMILES C(N=[N+]=[N-])CCCS(=O)C1=CC=C(C=C1)C
SPLASH splash10-000f-7940000000-b0f8471aab7a6f3538fa
Source of Spectrum ACI-57-SM11-1t (DOI: 10.1002/anie.201804284)
Thin-Layer Chromatography 0.32 (pentane/EtOAc, 1:1)
Wiley ID 1893332