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1,3,5-cycloheptatriene-1-carbaldehyde
SpectraBase Compound ID JovpXBtCCsL
InChI InChI=1S/C8H8O/c9-7-8-5-3-1-2-4-6-8/h1-5,7H,6H2
InChIKey NCPTVZJYPXMSFL-UHFFFAOYSA-N
Mol Weight 120.15 g/mol
Molecular Formula C8H8O
Exact Mass 120.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37RiZpjNtg
Name 1,3,5-cycloheptatriene-1-carbaldehyde
Alternate Name(s) 1-cyclohepta-1,3,5-trienecarboxaldehyde cyclohepta-1,3,5-triene-1-carbaldehyde
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O
InChI InChI=1S/C8H8O/c9-7-8-5-3-1-2-4-6-8/h1-5,7H,6H2
InChIKey NCPTVZJYPXMSFL-UHFFFAOYSA-N
Molecular Weight 120.151 g/mol
SMILES C1(=CC=CC=CC1)C=O
SPLASH splash10-0006-9400000000-c300c16ab4496767a3ca
Source of Spectrum AJ-66-278-6
Wiley ID 771944