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1,9-Hexadecanediol, 1-acetate
SpectraBase Compound ID E2V8shITnmb
InChI InChI=1S/C18H36O3/c1-3-4-5-8-11-14-18(20)15-12-9-6-7-10-13-16-21-17(2)19/h18,20H,3-16H2,1-2H3
InChIKey XDXICCKXYKDHPH-UHFFFAOYSA-N
Mol Weight 300.5 g/mol
Molecular Formula C18H36O3
Exact Mass 300.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lc8G8YFUjFt
Name 1,9-Hexadecanediol, 1-acetate
CAS Registry Number 84867-73-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H36O3
InChI InChI=1S/C18H36O3/c1-3-4-5-8-11-14-18(20)15-12-9-6-7-10-13-16-21-17(2)19/h18,20H,3-16H2,1-2H3
InChIKey XDXICCKXYKDHPH-UHFFFAOYSA-N
Molecular Weight 300.483 g/mol
SMILES OC(CCCCCCCCOC(=O)C)CCCCCCC
SPLASH splash10-0h90-0920000000-777c7cc0bd0dc4683d19
Source of Spectrum KO-12-205-22
Synonyms 9-Hydroxyhexadecan-1-yl acetate 9-Hydroxyhexadecyl acetate
Wiley ID 1303164