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Indoxan
SpectraBase Compound ID IGHWSUEIu1Y
InChI InChI=1S/C11H12O2/c1-2-4-10-8(3-1)5-9-6-12-13-7-11(9)10/h1-4,9,11H,5-7H2
InChIKey NOMCNVAASJLMDV-UHFFFAOYSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmK7N7Pe0PH
Name Indoxan
CAS Registry Number 18096-62-3
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 176.083729624 u
Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-2-4-10-8(3-1)5-9-6-12-13-7-11(9)10/h1-4,9,11H,5-7H2
InChIKey NOMCNVAASJLMDV-UHFFFAOYSA-N
Molecular Weight 176.215 g/mol
Number of Peaks 50
RI1 1479
RI2 1157
SMILES c12ccccc2C2C(C1)COOC2
SPLASH splash10-014j-1900000000-11cd35bce30bdf796314
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Indeno[1,2-d]-1,3-dioxin, 4,4a,5,9b-tetrahydro-
Wiley ID LM_FFNSC3_1240