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4-(Methylthio)phenyl-N,N-diisopropylcarbamate
SpectraBase Compound ID GCRy8hvVKEm
InChI InChI=1S/C14H21NO2S/c1-10(2)15(11(3)4)14(16)17-12-6-8-13(18-5)9-7-12/h6-11H,1-5H3
InChIKey SJEJPXWPZFCBAB-UHFFFAOYSA-N
Mol Weight 267.39 g/mol
Molecular Formula C14H21NO2S
Exact Mass 267.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ltnfewz8OO5
Name 4-(Methylthio)phenyl-N,N-diisopropylcarbamate
Appearance Colourless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.129300092 u
Formula C14H21NO2S
InChI InChI=1S/C14H21NO2S/c1-10(2)15(11(3)4)14(16)17-12-6-8-13(18-5)9-7-12/h6-11H,1-5H3
InChIKey SJEJPXWPZFCBAB-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000 or HP 5890-5989B
Ionization Type EI
Literature Reference DOI 10.1002/chem.202201154
Molecular Weight 267.387 g/mol
Quality 180
Reported Formula C14H21NO2S
SMILES C1=CC(=CC=C1OC(N(C(C)C)C(C)C)=O)SC
SPLASH splash10-002o-6910000000-4f99236bb126b5cb03aa
Source of Spectrum QE-28-SM4-2v (DOI: 10.1002/chem.202201154)
Wiley ID 1900504