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Benzene, 1-isocyano-2-methyl-
SpectraBase Compound ID 3j40ZpWxjWe
InChI InChI=1S/C8H7N/c1-7-5-3-4-6-8(7)9-2/h3-6H,1H3
InChIKey HGHZICGHCZFYNX-UHFFFAOYSA-N
Mol Weight 117.15 g/mol
Molecular Formula C8H7N
Exact Mass 117.057849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CVrB5cacsv7
Name Benzene, 1-isocyano-2-methyl-
CAS Registry Number 10468-64-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N
InChI InChI=1S/C8H7N/c1-7-5-3-4-6-8(7)9-2/h3-6H,1H3
InChIKey HGHZICGHCZFYNX-UHFFFAOYSA-N
Molecular Weight 117.151 g/mol
SMILES Cc1ccccc1[N+]#[C-]
SPLASH splash10-014i-9600000000-1ec55f0a6063785206e6
Source of Spectrum T-68-1036-0
Synonyms 1-isocyano-2-methyl-benzene o-Tolyl isocyanide
Wiley ID 3697