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

*Links on SpectraBase are not permalinks.
Bicyclo[2.2.1]hepta-2,5-diene-2-carboxylic acid, 3-(1-oxopropyl)-, methyl ester
SpectraBase Compound ID IBdSfX5ZCBf
InChI InChI=1S/C12H14O3/c1-3-9(13)10-7-4-5-8(6-7)11(10)12(14)15-2/h4-5,7-8H,3,6H2,1-2H3/t7-,8+/m0/s1
InChIKey LUDXESXJHDJPSC-JGVFFNPUSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 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 KGUoAWfbAXT
Name Bicyclo[2.2.1]hepta-2,5-diene-2-carboxylic acid, 3-(1-oxopropyl)-, methyl ester
Alternate Name(s) Methyl 3-propionylbicyclo[2.2.1]hepta-2,5-diene-2-carboxylate
CAS Registry Number 90407-69-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-3-9(13)10-7-4-5-8(6-7)11(10)12(14)15-2/h4-5,7-8H,3,6H2,1-2H3/t7-,8+/m0/s1
InChIKey LUDXESXJHDJPSC-JGVFFNPUSA-N
Molecular Weight 206.241 g/mol
SMILES C1(=C([C@@]2(C[C@]1(C=C2)[H])[H])C(=O)CC)C(=O)OC
SPLASH splash10-00os-3910000000-d292318a7fcc6289d27a
Source of Spectrum KC-1988-2915-16
Wiley ID 1204438