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3-Ethynylcyclododecanone

View entire compound with spectra: 1 MS (GC)

3-Ethynylcyclododecanone
SpectraBase Compound ID 9tNphZBN3Ps
InChI InChI=1S/C14H22O/c1-2-13-10-8-6-4-3-5-7-9-11-14(15)12-13/h1,13H,3-12H2
InChIKey STGUMGJKGFDLQB-UHFFFAOYSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FQPggaYDcc
Name 3-Ethynylcyclododecanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-2-13-10-8-6-4-3-5-7-9-11-14(15)12-13/h1,13H,3-12H2
InChIKey STGUMGJKGFDLQB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200490150
Molecular Weight 206.329 g/mol
SMILES C#CC1CC(=O)CCCCCCCCC1
SPLASH splash10-0ar1-9500000000-9422becdca552e750c8e
Source of Spectrum H-87-1655-32
Synonyms 3-Ethynylcyclododecan-1-one
Wiley ID 1785491