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(9E)-12-methyl-1-oxacyclododec-9-en-2-one

View entire compound with spectra: 1 NMR, and 3 MS (GC)

(9E)-12-methyl-1-oxacyclododec-9-en-2-one
SpectraBase Compound ID 4FPzpfLx2EE
InChI InChI=1S/C12H20O2/c1-11-9-7-5-3-2-4-6-8-10-12(13)14-11/h5,7,11H,2-4,6,8-10H2,1H3/b7-5+
InChIKey IYNKPPZNZQQWKC-FNORWQNLSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GutTBZMN3p
Name (9E)-12-methyl-1-oxacyclododec-9-en-2-one
Alternate Name(s) Oxacyclododec-9-en-2-one, 12-methyl-, (E)- 12-Methyloxacyclododec-9-en-2-one
CAS Registry Number 33644-08-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-11-9-7-5-3-2-4-6-8-10-12(13)14-11/h5,7,11H,2-4,6,8-10H2,1H3/b7-5+
InChIKey IYNKPPZNZQQWKC-FNORWQNLSA-N
Molecular Weight 196.290 g/mol
SMILES C1CCCC(OC(C\C=C\CC1)C)=O
SPLASH splash10-00kb-9200000000-e12436a2b6264c00dd3a
Wiley ID 1487069