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Acetonitrile, (2-phenyl-1-oxaspiro[2.4]hept-4-ylidene)-, [2.alpha.,3.beta.(Z)]-
SpectraBase Compound ID GOSnzuLOJP
InChI InChI=1S/C14H13NO/c15-10-8-12-7-4-9-14(12)13(16-14)11-5-2-1-3-6-11/h1-3,5-6,8,13H,4,7,9H2/b12-8+
InChIKey JNZNPKAJHRFKQT-XYOKQWHBSA-N
Mol Weight 211.26 g/mol
Molecular Formula C14H13NO
Exact Mass 211.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CuJPrwjqRZH
Name Acetonitrile, (2-phenyl-1-oxaspiro[2.4]hept-4-ylidene)-, [2.alpha.,3.beta.(Z)]-
Alternate Name(s) Acetonitrile, (2-phenyl-1-oxaspiro[2.4]hept-4-ylidene)-, [2.alpha.,3.beta.(E)]- (2E)-(2-phenyl-1-oxaspiro[2.4]hept-4-ylidene)ethanenitrile 1-Oxaspiro[2.4]heptane, acetonitrile deriv. 4-(e-cyanomethylene)-2(E)-phenyl-1-oxaspiro[2.4]heptane 4-(z-cyanomethylene)-2(E)-phenyl-1-oxaspiro[2.4]heptane
CAS Registry Number 70388-70-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO
InChI InChI=1S/C14H13NO/c15-10-8-12-7-4-9-14(12)13(16-14)11-5-2-1-3-6-11/h1-3,5-6,8,13H,4,7,9H2/b12-8+
InChIKey JNZNPKAJHRFKQT-XYOKQWHBSA-N
Molecular Weight 211.264 g/mol
SMILES C12(OC2c2ccccc2)\C(=C\C#N)CCC1
SPLASH splash10-0a4l-9210000000-7b4248fa35ccdeea7fd1
Source of Spectrum K-113-894-0
Wiley ID 1210598