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3-Cyanocyclododecanone
SpectraBase Compound ID LdFtT83D8Vi
InChI InChI=1S/C13H21NO/c14-11-12-8-6-4-2-1-3-5-7-9-13(15)10-12/h12H,1-10H2
InChIKey JSBMXPOTCHWBFX-UHFFFAOYSA-N
Mol Weight 207.32 g/mol
Molecular Formula C13H21NO
Exact Mass 207.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vOPBR1e3U
Name 3-Cyanocyclododecanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO
InChI InChI=1S/C13H21NO/c14-11-12-8-6-4-2-1-3-5-7-9-13(15)10-12/h12H,1-10H2
InChIKey JSBMXPOTCHWBFX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200490150
Molecular Weight 207.317 g/mol
SMILES C(C1CC(=O)CCCCCCCCC1)#N
SPLASH splash10-0bu1-9500000000-7c4920c72943cae96ea1
Source of Spectrum H-87-1656-37
Synonyms 3-Oxocyclododecane-1-carbonitrile
Wiley ID 1785493