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1H-Indeno[1,2-c]furan-3a(3H)-carbonitrile, octahydro-3-imino-7a-methyl-, (3a.alpha.,3b.beta.,7a.beta.,8a.alpha.)-
SpectraBase Compound ID HgfuDI692ys
InChI InChI=1S/C13H18N2O/c1-12-5-3-2-4-10(12)13(8-14)9(6-12)7-16-11(13)15/h9-10,15H,2-7H2,1H3/t9-,10+,12+,13+/m1/s1
InChIKey KESQJNDZSWSXIQ-URBCHYCLSA-N
Mol Weight 218.3 g/mol
Molecular Formula C13H18N2O
Exact Mass 218.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9RixylWHgFl
Name 1H-Indeno[1,2-c]furan-3a(3H)-carbonitrile, octahydro-3-imino-7a-methyl-, (3a.alpha.,3b.beta.,7a.beta.,8a.alpha.)-
CAS Registry Number 131581-09-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2O
InChI InChI=1S/C13H18N2O/c1-12-5-3-2-4-10(12)13(8-14)9(6-12)7-16-11(13)15/h9-10,15H,2-7H2,1H3/t9-,10+,12+,13+/m1/s1
InChIKey KESQJNDZSWSXIQ-URBCHYCLSA-N
Molecular Weight 218.300 g/mol
SMILES N=C1[C@]2([C@](C[C@]3([C@@]2(CCCC3)[H])C)(CO1)[H])C#N
SPLASH splash10-0ab9-0920000000-20da7ca40ca29b1deb7b
Source of Spectrum B-43-1321-22
Synonyms (3aR,3bS,7aS,8aS)-3-imino-7a-methyloctahydro-1H-indeno[1,2-c]furan-3a(3H)-carbonitrile 5-Methyl-11-cyano-12-imino-1-oxatricyclo[7.3.0(5,10).0(3,11)]dodecane
Wiley ID 1217843