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3(2H)-Benzofuranone, 6-methoxy-2-(phenylmethylene-d)-
SpectraBase Compound ID DlObXCDU5rP
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+/i9D
InChIKey LKWWJGGLULNRBP-GARDXNNMSA-N
Mol Weight 253.28 g/mol
Molecular Formula C16H112DO3
Exact Mass 253.084921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5d7OoNVLZLX
Name 3(2H)-Benzofuranone, 6-methoxy-2-(phenylmethylene-d)-
Alternate Name(s) 6-Methoxy-.beta.-deuterio-2-benzylidenecoumaran-3-one
CAS Registry Number 87931-09-7
Comments Less than 3 mono-isotopic peaks
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Formula C16H11DO3
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+/i9D
InChIKey LKWWJGGLULNRBP-GARDXNNMSA-N
Molecular Weight 253.275 g/mol
SMILES C1(\C(Oc2cc(ccc12)OC)=C/(c1ccccc1)[2D])=O
SPLASH splash10-0udi-0090000000-459c77f138dcebed8fe4
Source of Spectrum O-18-356-1
Wiley ID 1256052