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1,4,7-Benzotrioxonin, 2,3,5,6-tetrahydro-

View entire compound with spectra: 2 MS (GC)

1,4,7-Benzotrioxonin, 2,3,5,6-tetrahydro-
SpectraBase Compound ID 4uCC1frHAza
InChI InChI=1S/C10H12O3/c1-2-4-10-9(3-1)12-7-5-11-6-8-13-10/h1-4H,5-8H2
InChIKey HOWRGZDIVIHRJM-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8UE2nMHSuZ
Name 1,4,7-Benzotrioxonin, 2,3,5,6-tetrahydro-
CAS Registry Number 17454-39-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-2-4-10-9(3-1)12-7-5-11-6-8-13-10/h1-4H,5-8H2
InChIKey HOWRGZDIVIHRJM-UHFFFAOYSA-N
Molecular Weight 180.203 g/mol
SMILES c1ccc2c(c1)OCCOCCO2
SPLASH splash10-008i-8900000000-0accfdbed02c2bd1cce3
Source of Spectrum W5-0-0-0
Synonyms 2,3,5,6-Tetrahydro-1,4,7-benzotrioxonine 2,3,5,6-tetrahydro-1,4,7-benzotrioxonin
Wiley ID 1176191