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1-[(4-Azidobutyl)sulfinyl]-4-chlorobenzene
SpectraBase Compound ID CmZDO6y32wX
InChI InChI=1S/C10H12ClN3OS/c11-9-3-5-10(6-4-9)16(15)8-2-1-7-13-14-12/h3-6H,1-2,7-8H2
InChIKey XAOXNXVLZLYELO-UHFFFAOYSA-N
Mol Weight 257.74 g/mol
Molecular Formula C10H12ClN3OS
Exact Mass 257.038961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUCmWf9Qn1w
Name 1-[(4-Azidobutyl)sulfinyl]-4-chlorobenzene
Appearance Light yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 257.038960891 u
Formula C10H12ClN3OS
InChI InChI=1S/C10H12ClN3OS/c11-9-3-5-10(6-4-9)16(15)8-2-1-7-13-14-12/h3-6H,1-2,7-8H2
InChIKey XAOXNXVLZLYELO-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804284
Quality 68
SMILES C(N=[N+]=[N-])CCCS(=O)C1=CC=C(C=C1)Cl
SPLASH splash10-0di0-0960000000-8412908051d48aa88fc0
Source of Spectrum ACI-57-SM11-1u (DOI: 10.1002/anie.201804284)
Thin-Layer Chromatography 0.32 (pentane/EtOAc, 1:1)
Wiley ID 1893333