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3-(8-Bromooctyl)catechol Diacetate
SpectraBase Compound ID GpAkDCPAXhR
InChI InChI=1S/C18H25BrO4/c1-14(20)22-17-12-9-11-16(18(17)23-15(2)21)10-7-5-3-4-6-8-13-19/h9,11-12H,3-8,10,13H2,1-2H3
InChIKey KNESVWXEHBZFIO-UHFFFAOYSA-N
Mol Weight 385.3 g/mol
Molecular Formula C18H25BrO4
Exact Mass 384.093622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pp1poPtJNa
Name 3-(8-Bromooctyl)catechol Diacetate
Alternate Name(s) 2-(acetyloxy)-3-(8-bromooctyl)phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25BrO4
InChI InChI=1S/C18H25BrO4/c1-14(20)22-17-12-9-11-16(18(17)23-15(2)21)10-7-5-3-4-6-8-13-19/h9,11-12H,3-8,10,13H2,1-2H3
InChIKey KNESVWXEHBZFIO-UHFFFAOYSA-N
Molecular Weight 385.298 g/mol
SMILES c1(c(OC(=O)C)cccc1CCCCCCCCBr)OC(=O)C
SPLASH splash10-0uk9-0509000000-4e39b2cb624d4715539f
Source of Spectrum AJ-64-2561-7
Wiley ID 1361388