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Acetonitrile, (2-phenyl-1-oxaspiro[2.6]non-4-ylidene)-, [2.alpha.,3.beta.(E)]-
SpectraBase Compound ID AIIoumpb2wt
InChI InChI=1S/C16H17NO/c17-12-10-14-9-5-2-6-11-16(14)15(18-16)13-7-3-1-4-8-13/h1,3-4,7-8,10,15H,2,5-6,9,11H2/b14-10+
InChIKey CYNCNFJZMXGNDE-GXDHUFHOSA-N
Mol Weight 239.32 g/mol
Molecular Formula C16H17NO
Exact Mass 239.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KpAzRXQrPN
Name Acetonitrile, (2-phenyl-1-oxaspiro[2.6]non-4-ylidene)-, [2.alpha.,3.beta.(E)]-
CAS Registry Number 70388-67-9
Comments Less than 3 mono-isotopic peaks
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Formula C16H17NO
InChI InChI=1S/C16H17NO/c17-12-10-14-9-5-2-6-11-16(14)15(18-16)13-7-3-1-4-8-13/h1,3-4,7-8,10,15H,2,5-6,9,11H2/b14-10+
InChIKey CYNCNFJZMXGNDE-GXDHUFHOSA-N
Molecular Weight 239.318 g/mol
SMILES C12(OC2c2ccccc2)\C(=C\C#N)CCCCC1
SPLASH splash10-000i-0090000000-82fab5b13436c6be1d9b
Source of Spectrum K-113-896-0
Synonyms (2E)-(2-phenyl-1-oxaspiro[2.6]non-4-ylidene)ethanenitrile 1-Oxaspiro[2.6]nonane, acetonitrile deriv. 4-(e-cyanomethylene)-2(E)-phenyl-1-oxaspiro[2.6]nonane
Wiley ID 1242134