Debug Info

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2kPoz845vzw
spectrumID
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2kPoz845vzw
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12H-Benzo[b]xanthen-12-one, 11-(acetyloxy)-3-methoxy-
SpectraBase Compound ID JakpoKe6RtJ
InChI InChI=1S/C20H14O5/c1-11(21)24-20-14-6-4-3-5-12(14)9-17-18(20)19(22)15-8-7-13(23-2)10-16(15)25-17/h3-10H,1-2H3
InChIKey XZTMZERZIUHPCC-UHFFFAOYSA-N
Mol Weight 334.33 g/mol
Molecular Formula C20H14O5
Exact Mass 334.084124 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kPoz845vzw
Name 12H-Benzo[b]xanthen-12-one, 11-(acetyloxy)-3-methoxy-
CAS Registry Number 89140-99-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14O5
InChI InChI=1S/C20H14O5/c1-11(21)24-20-14-6-4-3-5-12(14)9-17-18(20)19(22)15-8-7-13(23-2)10-16(15)25-17/h3-10H,1-2H3
InChIKey XZTMZERZIUHPCC-UHFFFAOYSA-N
Molecular Weight 334.327 g/mol
SMILES c12C(c3ccc(cc3Oc2cc2ccccc2c1OC(=O)C)OC)=O
SPLASH splash10-0006-0090000000-0be6dde16073e021c3e2
Source of Spectrum KC-1983-2818-0
Synonyms acetic acid (3-methoxy-12-oxo-11-benzo[b]xanthenyl) ester (3-methoxy-12-oxobenzo[b]xanthen-11-yl) acetate (3-methoxy-12-oxo-benzo[b]xanthen-11-yl) acetate (3-methoxy-12-oxidanylidene-benzo[b]xanthen-11-yl) ethanoate
Wiley ID 1331023
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