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2-Acetoxy-6-hydroxy-1,3-dicyanoazulene
SpectraBase Compound ID 6yUG2ti9P4H
InChI InChI=1S/C14H8N2O3/c1-8(17)19-14-12(6-15)10-4-2-9(18)3-5-11(10)13(14)7-16/h2-5,18H,1H3
InChIKey MPPBURGWMODTKP-UHFFFAOYSA-N
Mol Weight 252.23 g/mol
Molecular Formula C14H8N2O3
Exact Mass 252.053492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKnr9BiJqh9
Name 2-Acetoxy-6-hydroxy-1,3-dicyanoazulene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8N2O3
InChI InChI=1S/C14H8N2O3/c1-8(17)19-14-12(6-15)10-4-2-9(18)3-5-11(10)13(14)7-16/h2-5,18H,1H3
InChIKey MPPBURGWMODTKP-UHFFFAOYSA-N
Molecular Weight 252.229 g/mol
SMILES Oc1ccc2c(c(c(c2cc1)C#N)OC(=O)C)C#N
SPLASH splash10-0w29-0090000000-4ba06ec0cf53dc03fa7a
Source of Spectrum QA-40-595-5
Synonyms 1,3-dicyano-6-hydroxy-2-azulenyl acetate
Wiley ID 861622