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Methyl 2-[2'-(isocyanatosulfonyl)ethyl]-3-methylbenzoate
SpectraBase Compound ID 2sbtybYucSv
InChI InChI=1S/C10H9NO5S/c1-16-10(13)9-5-3-2-4-8(9)6-17(14,15)11-7-12/h2-5H,6H2,1H3
InChIKey HPFGDWSUQHUCBU-UHFFFAOYSA-N
Mol Weight 255.24 g/mol
Molecular Formula C10H9NO5S
Exact Mass 255.020144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kgw3DoI3Q4Y
Name Methyl 2-[2'-(isocyanatosulfonyl)ethyl]-3-methylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO5S
InChI InChI=1S/C10H9NO5S/c1-16-10(13)9-5-3-2-4-8(9)6-17(14,15)11-7-12/h2-5H,6H2,1H3
InChIKey HPFGDWSUQHUCBU-UHFFFAOYSA-N
Molecular Weight 255.244 g/mol
SMILES C(S(N=C=O)(=O)=O)c1c(C(=O)OC)cccc1
SPLASH splash10-0007-9600000000-9c9d61c25ab18b75a42f
Source of Spectrum O-30-333-10
Synonyms Methyl 2-[2'-(isocyanatosulfonyl)methyl]-benzoate Methyl 2-(isocyanatosulfonylmethyl)benzoate
Wiley ID 1258554