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(S,Z)-2-Benzylidene-8-chloro-3-(2-oxopropyl)-2H-furo[3,2-c]chromen-4(3H)-one
SpectraBase Compound ID 1nyaIIguVBK
InChI InChI=1S/C21H15ClO4/c1-12(23)9-15-18(10-13-5-3-2-4-6-13)25-20-16-11-14(22)7-8-17(16)26-21(24)19(15)20/h2-8,10-11,15H,9H2,1H3/b18-10-/t15-/m1/s1
InChIKey VQQBOTDFXNTQPV-YQYFLZKSSA-N
Mol Weight 366.8 g/mol
Molecular Formula C21H15ClO4
Exact Mass 366.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJzmj6ccl1P
Name (S,Z)-2-Benzylidene-8-chloro-3-(2-oxopropyl)-2H-furo[3,2-c]chromen-4(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15ClO4
InChI InChI=1S/C21H15ClO4/c1-12(23)9-15-18(10-13-5-3-2-4-6-13)25-20-16-11-14(22)7-8-17(16)26-21(24)19(15)20/h2-8,10-11,15H,9H2,1H3/b18-10-/t15-/m1/s1
InChIKey VQQBOTDFXNTQPV-YQYFLZKSSA-N
Literature Reference DOI 10.1021/ol502551u
Molecular Weight 366.800 g/mol
SMILES c1(\C=C\2[C@@](CC(C)=O)(C3=C(O2)c2cc(ccc2OC3=O)Cl)[H])ccccc1
SPLASH splash10-002f-5901000000-ab6f49cf0a4892053de5
Source of Spectrum A1-16-5188/SM27-4q
Wiley ID 1751370