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1-benzyl-1H-imidazole-5-carbaldehyde
SpectraBase Compound ID 3SQS5W3wAPx
InChI InChI=1S/C11H10N2O/c14-8-11-6-12-9-13(11)7-10-4-2-1-3-5-10/h1-6,8-9H,7H2
InChIKey QONDAZCJAPQGRX-UHFFFAOYSA-N
Mol Weight 186.21 g/mol
Molecular Formula C11H10N2O
Exact Mass 186.079313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HpjHsbDefnu
Name 1-benzyl-1H-imidazole-5-carbaldehyde
Alternate Name(s) 3-(phenylmethyl)-4-imidazolecarboxaldehyde 3-(phenylmethyl)imidazole-4-carbaldehyde 3-benzylimidazole-4-carbaldehyde
CAS Registry Number 85102-99-4
Comments Less than 3 mono-isotopic peaks
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Formula C11H10N2O
InChI InChI=1S/C11H10N2O/c14-8-11-6-12-9-13(11)7-10-4-2-1-3-5-10/h1-6,8-9H,7H2
InChIKey QONDAZCJAPQGRX-UHFFFAOYSA-N
Molecular Weight 186.214 g/mol
SMILES c1ncc([n]1Cc1ccccc1)C=O
SPLASH splash10-001i-9400000000-e82381bfc448fb2fa7d9
Source of Spectrum SO-0-148-0
Wiley ID 1544732