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1-[(3-Azidopropyl)sulfinyl]-3-methylbenzene
SpectraBase Compound ID 1CgbujJ5Ti5
InChI InChI=1S/C10H13N3OS/c1-9-4-2-5-10(8-9)15(14)7-3-6-12-13-11/h2,4-5,8H,3,6-7H2,1H3
InChIKey GFQILYWVZTVWDY-UHFFFAOYSA-N
Mol Weight 223.29 g/mol
Molecular Formula C10H13N3OS
Exact Mass 223.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID O7Eyuo3h5S
Name 1-[(3-Azidopropyl)sulfinyl]-3-methylbenzene
Appearance Light yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.077933224 u
Formula C10H13N3OS
InChI InChI=1S/C10H13N3OS/c1-9-4-2-5-10(8-9)15(14)7-3-6-12-13-11/h2,4-5,8H,3,6-7H2,1H3
InChIKey GFQILYWVZTVWDY-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804284
Molecular Weight 223.294 g/mol
Quality 44
SMILES C(N=[N+]=[N-])CCS(=O)C1=CC(=CC=C1)C
SPLASH splash10-0006-7900000000-d0537259722b7a4390c8
Source of Spectrum ACI-57-SM9-1g (DOI: 10.1002/anie.201804284)
Thin-Layer Chromatography 0.33 (pentane/EtOAc, 1:1)
Wiley ID 1893322