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

*Links on SpectraBase are not permalinks.
4,7-Methano-1H-indene-3-carboxylic acid, 3a,4,7,7a-tetrahydro-1-oxo-2-phenyl-, ethyl ester, (3a.alpha.,4.beta.,7.beta.,7a.alpha.)-
SpectraBase Compound ID 352C5slgucZ
InChI InChI=1S/C19H18O3/c1-2-22-19(21)17-14-12-8-9-13(10-12)16(14)18(20)15(17)11-6-4-3-5-7-11/h3-9,12-14,16H,2,10H2,1H3/t12-,13+,14+,16-/m1/s1
InChIKey DWSVKKORMVQHCN-ORIJERBGSA-N
Mol Weight 294.35 g/mol
Molecular Formula C19H18O3
Exact Mass 294.125594 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 9fNwDoIOpQi
Name 4,7-Methano-1H-indene-3-carboxylic acid, 3a,4,7,7a-tetrahydro-1-oxo-2-phenyl-, ethyl ester, (3a.alpha.,4.beta.,7.beta.,7a.alpha.)-
Alternate Name(s) Ethyl (1S,2S,6R,7R)-5-oxo-4-phenyltricyclo[5.2.1.0(2,6)]deca-3,8-diene-3-carboxylate exo-2-phenyl-3-ethoxycarbonyl-4,7-methano-3a,4,7,7a-tetrahydro-inden-1-one
CAS Registry Number 65055-60-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O3
InChI InChI=1S/C19H18O3/c1-2-22-19(21)17-14-12-8-9-13(10-12)16(14)18(20)15(17)11-6-4-3-5-7-11/h3-9,12-14,16H,2,10H2,1H3/t12-,13+,14+,16-/m1/s1
InChIKey DWSVKKORMVQHCN-ORIJERBGSA-N
Molecular Weight 294.350 g/mol
SMILES C1(=C(C(=O)[C@]2([C@@]1([C@@]1(C=C[C@@]2([H])C1)[H])[H])[H])c1ccccc1)C(=O)OCC
SPLASH splash10-05di-1690000000-c117396e6e29166b9608
Source of Spectrum H-60-2167-0
Wiley ID 1297540