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2,3-Dihydro-1H-8-methoxy-5-methyl-2,2-benzocycloheptenedicarboxylic acid diethyl ester
SpectraBase Compound ID 8b3Rawjolwm
InChI InChI=1S/C19H24O5/c1-5-23-17(20)19(18(21)24-6-2)10-9-13(3)16-8-7-15(22-4)11-14(16)12-19/h7-9,11H,5-6,10,12H2,1-4H3
InChIKey IUQRNADHGZFFJJ-UHFFFAOYSA-N
Mol Weight 332.4 g/mol
Molecular Formula C19H24O5
Exact Mass 332.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWnUiLCE0Eg
Name 2,3-Dihydro-1H-8-methoxy-5-methyl-2,2-benzocycloheptenedicarboxylic acid diethyl ester
Alternate Name(s) 3-methoxy-9-methyl-5,7-dihydrobenzo[7]annulene-6,6-dicarboxylic acid diethyl ester diethyl 3-methoxy-9-methyl-5,7-dihydrobenzo[7]annulene-6,6-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C19H24O5
InChI InChI=1S/C19H24O5/c1-5-23-17(20)19(18(21)24-6-2)10-9-13(3)16-8-7-15(22-4)11-14(16)12-19/h7-9,11H,5-6,10,12H2,1-4H3
InChIKey IUQRNADHGZFFJJ-UHFFFAOYSA-N
Molecular Weight 332.396 g/mol
SMILES C1(Cc2c(ccc(c2)OC)C(=CC1)C)(C(=O)OCC)C(=O)OCC
SPLASH splash10-000i-0901000000-56a9c4282995a0a44f5e
Source of Spectrum J-65-4917-24
Wiley ID 1532949