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(E,2R*,6S*)-2-Methyl-1,7-dioxaspiro[5.6]dodec-9-ylideneacetonitrile
SpectraBase Compound ID EZL1zgwC2FL
InChI InChI=1S/C13H19NO2/c1-11-4-2-7-13(16-11)8-3-5-12(6-9-14)10-15-13/h6,11H,2-5,7-8,10H2,1H3/b12-6+/t11-,13-/m1/s1
InChIKey HYDSWRKWTRZGHD-URFGDBDFSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7E4sIrJopA0
Name (E,2R*,6S*)-2-Methyl-1,7-dioxaspiro[5.6]dodec-9-ylideneacetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-11-4-2-7-13(16-11)8-3-5-12(6-9-14)10-15-13/h6,11H,2-5,7-8,10H2,1H3/b12-6+/t11-,13-/m1/s1
InChIKey HYDSWRKWTRZGHD-URFGDBDFSA-N
Molecular Weight 221.300 g/mol
SMILES [C@@]12(O[C@](C)(CCC2)[H])OC\C(=C\C#N)CCC1
SPLASH splash10-0udi-2910000000-7329e83ba9cda683fd21
Source of Spectrum F2-43-1627-2
Synonyms (2E)-2-[(4R,6S)-4-methyl-5,12-dioxaspiro[5.6]dodecan-10-ylidene]acetonitrile (2E)-2-[(4R,6S)-4-methyl-5,12-dioxaspiro[5.6]dodecan-10-ylidene]ethanenitrile (2E)-[(2R,6S)-2-methyl-1,7-dioxaspiro[5.6]dodec-9-ylidene]ethanenitrile (2E)-2-[(2R,6S)-2-methyl-1,12-dioxaspiro[5.6]dodecan-10-ylidene]ethanenitrile
Wiley ID 1553129