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2(E)-Benzylidene-10-(methylene)-4-oxa-8,8-bis(methoxycarbonyl)bicyclo[4.4.0]dec-1(6)-ene
SpectraBase Compound ID AJvuF3g0STI
InChI InChI=1S/C21H22O5/c1-14-10-21(19(22)24-2,20(23)25-3)11-17-13-26-12-16(18(14)17)9-15-7-5-4-6-8-15/h4-9H,1,10-13H2,2-3H3/b16-9+
InChIKey ONJIRNTVVOPMCT-CXUHLZMHSA-N
Mol Weight 354.4 g/mol
Molecular Formula C21H22O5
Exact Mass 354.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YiTah3vsDu
Name 2(E)-Benzylidene-10-(methylene)-4-oxa-8,8-bis(methoxycarbonyl)bicyclo[4.4.0]dec-1(6)-ene
Alternate Name(s) (4Z)-5-methylene-4-(phenylmethylene)-6,8-dihydro-1H-2-benzopyran-7,7-dicarboxylic acid dimethyl ester dimethyl (4Z)-4-benzylidene-5-methylidene-6,8-dihydro-1H-isochromene-7,7-dicarboxylate dimethyl (4Z)-4-benzylidene-5-methylene-6,8-dihydro-1H-isochromene-7,7-dicarboxylate dimethyl (4Z)-5-methylidene-4-(phenylmethylidene)-6,8-dihydro-1H-isochromene-7,7-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C21H22O5
InChI InChI=1S/C21H22O5/c1-14-10-21(19(22)24-2,20(23)25-3)11-17-13-26-12-16(18(14)17)9-15-7-5-4-6-8-15/h4-9H,1,10-13H2,2-3H3/b16-9+
InChIKey ONJIRNTVVOPMCT-CXUHLZMHSA-N
Molecular Weight 354.402 g/mol
SMILES C1(CC(=C)C2=C(C1)COC\C2=C\c1ccccc1)(C(=O)OC)C(=O)OC
SPLASH splash10-0006-9001000000-86f57dae96e8eb11f589
Source of Spectrum J-65-8541-54
Wiley ID 1533857