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Anhydropisatin
SpectraBase Compound ID 14IiFTGLAwQ
InChI InChI=1S/C17H12O5/c1-18-9-2-3-10-13(4-9)19-7-12-11-5-15-16(21-8-20-15)6-14(11)22-17(10)12/h2-6H,7-8H2,1H3
InChIKey XWTCRKNSJARUIU-UHFFFAOYSA-N
Mol Weight 296.28 g/mol
Molecular Formula C17H12O5
Exact Mass 296.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iq6R0JhwBxO
Name Anhydropisatin
Alternate Name(s) Flemichapparin B
CAS Registry Number 3187-53-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O5
InChI InChI=1S/C17H12O5/c1-18-9-2-3-10-13(4-9)19-7-12-11-5-15-16(21-8-20-15)6-14(11)22-17(10)12/h2-6H,7-8H2,1H3
InChIKey XWTCRKNSJARUIU-UHFFFAOYSA-N
Molecular Weight 296.278 g/mol
SMILES c-12c(c3cc4OCOc4cc3o2)COc2c1ccc(OC)c2
SPLASH splash10-0002-0190000000-794802777ed32ca8833c
Source of Spectrum O-11-575-1
Wiley ID 1299082