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4,7-Methano-1H-indene-1,8-dicarboxylic acid, 3a,4,7,7a-tetrahydro-1,8-dimethyl-, diethyl ester, (1.alpha.,3a.beta.,4.beta.,7.beta.,7a.beta.,8R*)-
SpectraBase Compound ID IitCZNDWfcT
InChI InChI=1S/C18H24O4/c1-5-21-15(19)17(3)10-9-11-12-7-8-13(14(11)17)18(12,4)16(20)22-6-2/h7-14H,5-6H2,1-4H3/t11-,12+,13-,14-,17-,18-/m1/s1
InChIKey MGUYPRBBFVTGDO-WHGULVMYSA-N
Mol Weight 304.39 g/mol
Molecular Formula C18H24O4
Exact Mass 304.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBXPGpyO3YQ
Name 4,7-Methano-1H-indene-1,8-dicarboxylic acid, 3a,4,7,7a-tetrahydro-1,8-dimethyl-, diethyl ester, (1.alpha.,3a.beta.,4.beta.,7.beta.,7a.beta.,8R*)-
Alternate Name(s) Diethyl (1R,2R,3R,6R,7S,10R)-3,10-dimethyltricyclo[5.2.1.0(2,6)]deca-4,8-diene-3,10-dicarboxylate Diethyl 3a,4,7,7a-tetrahydro-1,8-dimethyl-4,7-methano-1H-indene-1,8-dicarboxylate
CAS Registry Number 110677-88-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O4
InChI InChI=1S/C18H24O4/c1-5-21-15(19)17(3)10-9-11-12-7-8-13(14(11)17)18(12,4)16(20)22-6-2/h7-14H,5-6H2,1-4H3/t11-,12+,13-,14-,17-,18-/m1/s1
InChIKey MGUYPRBBFVTGDO-WHGULVMYSA-N
Molecular Weight 304.386 g/mol
SMILES [C@]1([C@]2([C@@]3([C@@](C(=O)OCC)(C)C=C[C@@]3([C@@]1(C=C2)[H])[H])[H])[H])(C(=O)OCC)C
SPLASH splash10-0udi-3911000000-6210dcd1febc302ad3f6
Source of Spectrum H-70-591-9
Wiley ID 1306568