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1-Azuloyl cyanide
SpectraBase Compound ID 9HmDsAkSTNr
InChI InChI=1S/C12H7NO/c13-8-12(14)11-7-6-9-4-2-1-3-5-10(9)11/h1-7H
InChIKey IHILECPONRBQAX-UHFFFAOYSA-N
Mol Weight 181.19 g/mol
Molecular Formula C12H7NO
Exact Mass 181.052764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vzsFsNeAO8
Name 1-Azuloyl cyanide
CAS Registry Number 56454-37-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7NO
InChI InChI=1S/C12H7NO/c13-8-12(14)11-7-6-9-4-2-1-3-5-10(9)11/h1-7H
InChIKey IHILECPONRBQAX-UHFFFAOYSA-N
Molecular Weight 181.194 g/mol
SMILES c1(c2c(ccccc2)cc1)C(C#N)=O
SPLASH splash10-0a59-0900000000-3b728a6b7bb2fe6c85b1
Source of Spectrum J-40-3226-0
Synonyms 1-Azulenyl(oxo)acetonitrile Oxo-1-azulylethanenitrile
Wiley ID 1177660