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3(2H)-Benzofuranone, 6-methoxy-2-(phenyl-D5-methylene)-
SpectraBase Compound ID Fx4u2MuzBwD
InChI InChI=1S/C16H12O3/c1-18-12-7-8-13-14(10-12)19-15(16(13)17)9-11-5-3-2-4-6-11/h2-10H,1H3/b15-9-/i2D,3D,4D,5D,6D
InChIKey LKWWJGGLULNRBP-UOSMQVINSA-N
Mol Weight 257.3 g/mol
Molecular Formula C16H72D5O3
Exact Mass 257.110028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yaa6gyNr6v
Name 3(2H)-Benzofuranone, 6-methoxy-2-(phenyl-D5-methylene)-
CAS Registry Number 87931-10-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H7D5O3
InChI InChI=1S/C16H12O3/c1-18-12-7-8-13-14(10-12)19-15(16(13)17)9-11-5-3-2-4-6-11/h2-10H,1H3/b15-9-/i2D,3D,4D,5D,6D
InChIKey LKWWJGGLULNRBP-UOSMQVINSA-N
Molecular Weight 257.300 g/mol
SMILES C1(\C(Oc2cc(ccc12)OC)=C\c1c(c([2D])c(c(c1[2D])[2D])[2D])[2D])=O
SPLASH splash10-0a4i-0090000000-5821b2c0bd95574f55b2
Source of Spectrum O-18-356-1
Synonyms 6-Methoxy-2',3',4',5',6'-penta-deuterio-2-benzylidenecoumaran-3-one
Wiley ID 1256053