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4-(3-Phenylpropoxy)but-2-enenitrile
SpectraBase Compound ID B1oPDVQEgyc
InChI InChI=1S/C13H15NO/c14-10-4-5-11-15-12-6-9-13-7-2-1-3-8-13/h1-5,7-8H,6,9,11-12H2/b5-4+
InChIKey ZLMGQWXKROYUAY-SNAWJCMRSA-N
Mol Weight 201.27 g/mol
Molecular Formula C13H15NO
Exact Mass 201.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CiQfa8EnDaD
Name 4-(3-Phenylpropoxy)but-2-enenitrile
Alternate Name(s) (2E)-4-(3-phenylpropoxy)-2-butenenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C13H15NO
InChI InChI=1S/C13H15NO/c14-10-4-5-11-15-12-6-9-13-7-2-1-3-8-13/h1-5,7-8H,6,9,11-12H2/b5-4+
InChIKey ZLMGQWXKROYUAY-SNAWJCMRSA-N
Molecular Weight 201.269 g/mol
SMILES C(\C=C\COCCCc1ccccc1)#N
SPLASH splash10-014i-0940000000-321a4166a3ea08868f76
Source of Spectrum KC-61-7400-13
Wiley ID 1630010