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p-Tolyl isocyanate
SpectraBase Compound ID B1R5cKWvXOr
InChI InChI=1S/C8H7NO/c1-7-2-4-8(5-3-7)9-6-10/h2-5H,1H3
InChIKey MGYGFNQQGAQEON-UHFFFAOYSA-N
Mol Weight 133.15 g/mol
Molecular Formula C8H7NO
Exact Mass 133.052764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94ClITu2pKe
Name Benzene, 1-isocyanato-4-methyl-
CAS Registry Number 622-58-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NO
InChI InChI=1S/C8H7NO/c1-7-2-4-8(5-3-7)9-6-10/h2-5H,1H3
InChIKey MGYGFNQQGAQEON-UHFFFAOYSA-N
Molecular Weight 133.150 g/mol
SMILES c1(N=C=O)ccc(cc1)C
SPLASH splash10-001i-2900000000-ab19345fa7cb1b3f7ad6
Source of Spectrum IC-153-0-0
Synonyms 1-isocyanato-4-methyl-benzene 4-Isocyanato-1-methylbenzene 4-Isocyanatotoluene 4-Methylphenyl isocyanate 4-Tolyl isocyanate Isocyanic acid, p-tolyl ester p-Isocyanatotoluene p-Methylphenyl isocyanate p-Toluene isocyanate p-Tolyl isocyanate AI3-28256 EINECS 210-743-4
Wiley ID 1134350