For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5H-Benzocycloheptene-1,2-dicarboxylic acid, 6,7,8,9-tetrahydro-3,4-dimethyl-, dimethyl ester
SpectraBase Compound ID GXJoGNpMauC
InChI InChI=1S/C17H22O4/c1-10-11(2)14(16(18)20-3)15(17(19)21-4)13-9-7-5-6-8-12(10)13/h5-9H2,1-4H3
InChIKey CKBRCLZEXAXKDB-UHFFFAOYSA-N
Mol Weight 290.36 g/mol
Molecular Formula C17H22O4
Exact Mass 290.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EXiNkzqrpLz
Name 5H-Benzocycloheptene-1,2-dicarboxylic acid, 6,7,8,9-tetrahydro-3,4-dimethyl-, dimethyl ester
CAS Registry Number 105417-45-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O4
InChI InChI=1S/C17H22O4/c1-10-11(2)14(16(18)20-3)15(17(19)21-4)13-9-7-5-6-8-12(10)13/h5-9H2,1-4H3
InChIKey CKBRCLZEXAXKDB-UHFFFAOYSA-N
Molecular Weight 290.359 g/mol
SMILES c1(c(c(C)c(c2c1CCCCC2)C)C(=O)OC)C(=O)OC
SPLASH splash10-0pb9-0090000000-ead8a1e4f981f968785e
Source of Spectrum F-43-2964-10
Synonyms 6,7-bis(methoxycarbonyl)-8,9-dimethylcycloheptabenzene Dimethyl 3,4-dimethyl-6,7,8,9-tetrahydro-5H-benzo[a]cycloheptene-1,2-dicarboxylate
Wiley ID 1293716