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1-(4-Cyanophenyl)-2-propen-1-ol
SpectraBase Compound ID 81Hef2Emqp2
InChI InChI=1S/C10H9NO/c1-2-10(12)9-5-3-8(7-11)4-6-9/h2-6,10,12H,1H2
InChIKey IIBPXHXDBISNSC-UHFFFAOYSA-N
Mol Weight 159.19 g/mol
Molecular Formula C10H9NO
Exact Mass 159.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54iNUerIG
Name 1-(4-cyanophenyl)-prop-2-en-1-ol
Appearance Pale-yellow solid
Carrier Gas Hydrogen (1.2 bar) (30 ml/min)
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Exact Mass 159.068413913 u
Formula C10H9NO
GC Column Optima-1-MS (30 m x 0.25 mm)
GC Oven Program Oven temp 320oC
InChI InChI=1S/C10H9NO/c1-2-10(12)9-5-3-8(7-11)4-6-9/h2-6,10,12H,1H2
InChIKey IIBPXHXDBISNSC-UHFFFAOYSA-N
Instrument Name Agilent HP 6980 GC-5937N MSD
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202300050
Molecular Weight 159.188 g/mol
Quality 115
SMILES OC(C1=CC=C(C#N)C=C1)C=C
SPLASH splash10-0pc0-0900000000-e6f81383ff3e1aa821a3
Source of Spectrum K1-26-SM15-S18 (DOI: 10.1002/ejoc.202300050)
Thin-Layer Chromatography 0.21 (cHex/EtOAc, 4:1)
Wiley ID 1910457