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2-Ethylphenyl isocyanate
SpectraBase Compound ID GzZIc1ddhfU
InChI InChI=1S/C9H9NO/c1-2-8-5-3-4-6-9(8)10-7-11/h3-6H,2H2,1H3
InChIKey ZVFNUQWYLXXSJM-UHFFFAOYSA-N
Mol Weight 147.18 g/mol
Molecular Formula C9H9NO
Exact Mass 147.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jYF6EQPBFP
Name 1-Ethyl-2-isocyanato-benzene
CAS Registry Number 40411-25-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO
InChI InChI=1S/C9H9NO/c1-2-8-5-3-4-6-9(8)10-7-11/h3-6H,2H2,1H3
InChIKey ZVFNUQWYLXXSJM-UHFFFAOYSA-N
Molecular Weight 147.177 g/mol
SMILES c1(c(cccc1)CC)N=C=O
SPLASH splash10-001i-1900000000-5a8459cf5e402e3b0985
Source of Spectrum F-68-2963-18
Synonyms 2-Ethylphenyl isocyanate o-Ethylphenyl isocyanate
Wiley ID 1572281