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(3aRS,6SR,7aSR)-Dimethyl 6-methyl-3,3a,7,7a-tetrahydro-1H-indene-2,2(6H)-dicarboxylate
SpectraBase Compound ID 3xkx7Zb5IYb
InChI InChI=1S/C14H20O4/c1-9-4-5-10-7-14(12(15)17-2,13(16)18-3)8-11(10)6-9/h4-5,9-11H,6-8H2,1-3H3/t9-,10-,11+/m0/s1
InChIKey ZHZLQIUQQFHZAV-GARJFASQSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GlWhaGIhIt7
Name (3aRS,6SR,7aSR)-Dimethyl 6-methyl-3,3a,7,7a-tetrahydro-1H-indene-2,2(6H)-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-9-4-5-10-7-14(12(15)17-2,13(16)18-3)8-11(10)6-9/h4-5,9-11H,6-8H2,1-3H3/t9-,10-,11+/m0/s1
InChIKey ZHZLQIUQQFHZAV-GARJFASQSA-N
Literature Reference DOI 10.1002/adsc.201100658
Molecular Weight 252.310 g/mol
SMILES C1(C(OC)=O)(C[C@]2(C[C@](C=C[C@]2(C1)[H])(C)[H])[H])C(OC)=O
SPLASH splash10-000x-3900000000-05903b2a243f344dd8c6
Source of Spectrum ASC-353-3357/SM12-rac_2c
Synonyms (3aS,6R,7aR)-dimethyl 6-methyl-3,3a,7,7a-tetrahydro-1H-indene-2,2(6H)-dicarboxylate
Wiley ID 1762536