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13,13-dimethyltetradec-11-ynyl acetate
SpectraBase Compound ID 9Xue063zNNl
InChI InChI=1S/C18H32O2/c1-17(19)20-16-14-12-10-8-6-5-7-9-11-13-15-18(2,3)4/h5-12,14,16H2,1-4H3
InChIKey RAYWEIZRRNEUOF-UHFFFAOYSA-N
Mol Weight 280.5 g/mol
Molecular Formula C18H32O2
Exact Mass 280.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ImutyMEPEee
Name 13,13-dimethyltetradec-11-ynyl acetate
Alternate Name(s) 13,13-dimethyltetradec-11-ynyl ethanoate Acetic acid 13,13-dimethyltetradec-11-ynyl ester
CAS Registry Number 99798-73-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H32O2
InChI InChI=1S/C18H32O2/c1-17(19)20-16-14-12-10-8-6-5-7-9-11-13-15-18(2,3)4/h5-12,14,16H2,1-4H3
InChIKey RAYWEIZRRNEUOF-UHFFFAOYSA-N
Molecular Weight 280.452 g/mol
SMILES C(#CCCCCCCCCCCOC(=O)C)C(C)(C)C
SPLASH splash10-03dj-7900000000-0c4344683638787ed145
Source of Spectrum J-51-261-1
Wiley ID 1284336