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13,13,14,14,15,15,16,16,16-Nonadeuterio-hexadeca-11-enyl acetate
SpectraBase Compound ID 7xTWS3CEQta
InChI InChI=1S/C18H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h6-7H,3-5,8-17H2,1-2H3/b7-6+/i1D3,3D2,4D2,5D2
InChIKey BTKXLQSCEOHKTF-XXDFPIHASA-N
Mol Weight 291.52 g/mol
Molecular Formula C18H252D9O2
Exact Mass 291.312371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWqy83t4pW9
Name 13,13,14,14,15,15,16,16,16-Nonadeuterio-hexadeca-11-enyl acetate
Alternate Name(s) 13,13,14,14,15,15,16,1616-Nonadeuterio-hexadec-11-enyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25D9O2
InChI InChI=1S/C18H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h6-7H,3-5,8-17H2,1-2H3/b7-6+/i1D3,3D2,4D2,5D2
InChIKey BTKXLQSCEOHKTF-XXDFPIHASA-N
Molecular Weight 291.523 g/mol
SMILES C(=O)(OCCCCCCCCCC\C=C\C(C(C(C([2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])C
SPLASH splash10-0006-9010000000-024008b974d37bcd2c2d
Source of Spectrum U-1994-136-8
Wiley ID 765563