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[3-(4-chlorophenoxy)-2-sulfooxy-propyl] carbamate
SpectraBase Compound ID DNbpQfyWzFJ
InChI InChI=1S/C10H12ClNO7S/c11-7-1-3-8(4-2-7)17-5-9(6-18-10(12)13)19-20(14,15)16/h1-4,9H,5-6H2,(H2,12,13)(H,14,15,16)
InChIKey IETCKSSLVMTYAG-UHFFFAOYSA-N
Mol Weight 325.72 g/mol
Molecular Formula C10H12ClNO7S
Exact Mass 325.002301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dt7THXzmcn
Name [3-(4-chlorophenoxy)-2-sulfooxy-propyl] carbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12ClNO7S
InChI InChI=1S/C10H12ClNO7S/c11-7-1-3-8(4-2-7)17-5-9(6-18-10(12)13)19-20(14,15)16/h1-4,9H,5-6H2,(H2,12,13)(H,14,15,16)
InChIKey IETCKSSLVMTYAG-UHFFFAOYSA-N
Instrument Name 1310 Trace GC
Ionization Type EI
Literature Reference DOI 10.1002/rcm.9183
Molecular Weight 325.719 g/mol
SMILES NC(OCC(OS(O)(=O)=O)COc1ccc(cc1)Cl)=O
SPLASH splash10-00c0-0952000000-300eefc41b72539d27b5
Source of Spectrum RCM-35-5-Figure 5F
Wiley ID 1852161