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1,7-Dodecanediol, 1-acetate
SpectraBase Compound ID Fd3GlK2AUCI
InChI InChI=1S/C14H28O3/c1-3-4-7-10-14(16)11-8-5-6-9-12-17-13(2)15/h14,16H,3-12H2,1-2H3
InChIKey LXGXCRJSHAFMJO-UHFFFAOYSA-N
Mol Weight 244.37 g/mol
Molecular Formula C14H28O3
Exact Mass 244.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LrBqEpJgY0Q
Name 1,7-Dodecanediol, 1-acetate
CAS Registry Number 84867-78-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H28O3
InChI InChI=1S/C14H28O3/c1-3-4-7-10-14(16)11-8-5-6-9-12-17-13(2)15/h14,16H,3-12H2,1-2H3
InChIKey LXGXCRJSHAFMJO-UHFFFAOYSA-N
Molecular Weight 244.375 g/mol
SMILES OC(CCCCCCOC(=O)C)CCCCC
SPLASH splash10-000t-9300000000-0b2482aa6fc3d442983d
Source of Spectrum KO-12-205-31
Synonyms 7-Hydroxydodecan-1-yl acetate 7-Hydroxydodecyl acetate
Wiley ID 1247221