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9-(Ethoxycarbonyl)-1,2,3,4-tetrahydro-6-methoxy-5H-benzocyclohepten-5-one
SpectraBase Compound ID 2bzcUSATxjY
InChI InChI=1S/C15H18O4/c1-3-19-15(17)12-8-9-13(18-2)14(16)11-7-5-4-6-10(11)12/h8-9H,3-7H2,1-2H3
InChIKey ZYWCEXDOSIXNBM-UHFFFAOYSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAzYdUg7E8r
Name 9-(Ethoxycarbonyl)-1,2,3,4-tetrahydro-6-methoxy-5H-benzocyclohepten-5-one
Alternate Name(s) Ethyl 8-methoxy-9-oxo-2,3,4,9-tetrahydro-1H-benzo[a]cycloheptene-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-3-19-15(17)12-8-9-13(18-2)14(16)11-7-5-4-6-10(11)12/h8-9H,3-7H2,1-2H3
InChIKey ZYWCEXDOSIXNBM-UHFFFAOYSA-N
Molecular Weight 262.305 g/mol
SMILES C12=C(C(C(OC)=CC=C2C(=O)OCC)=O)CCCC1
SPLASH splash10-03e9-1490000000-7baedf28fb6110d66de8
Source of Spectrum F-50-9890-5
Wiley ID 1265939