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2-cyano-1-(5-methyl-2-oxahex-4-enyl)naphthalene
SpectraBase Compound ID 6tcF1MPh9Lh
InChI InChI=1S/C17H17NO/c1-13(2)9-10-19-12-17-15(11-18)8-7-14-5-3-4-6-16(14)17/h3-9H,10,12H2,1-2H3
InChIKey AEMKPGIGTRCWIV-UHFFFAOYSA-N
Mol Weight 251.33 g/mol
Molecular Formula C17H17NO
Exact Mass 251.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BfPvD3GfctO
Name 2-cyano-1-(5-methyl-2-oxahex-4-enyl)naphthalene
Appearance Yellow oil
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Exact Mass 251.131014170 u
Formula C17H17NO
InChI InChI=1S/C17H17NO/c1-13(2)9-10-19-12-17-15(11-18)8-7-14-5-3-4-6-16(14)17/h3-9H,10,12H2,1-2H3
InChIKey AEMKPGIGTRCWIV-UHFFFAOYSA-N
Instrument Name JEOL JMS-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/ejoc.202201051
Molecular Weight 251.329 g/mol
Quality 188
Reported Formula C17H17NO
SMILES C=1(C(=CC=C2C=CC=CC12)C#N)COCC=C(C)C
SPLASH splash10-014i-2910000000-f24c275801e3b2b56598
Source of Spectrum K1-2022-10-6d (DOI: 10.1002/ejoc.202201051)
Wiley ID 1898985