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1,2-Naphthalenedicarboxylic acid, 1,5,6,7,8,8a-hexahydro-, dimethyl ester, trans-(.+-.)-
SpectraBase Compound ID 1ufkO00TdiV
InChI InChI=1S/C14H18O4/c1-17-13(15)11-8-7-9-5-3-4-6-10(9)12(11)14(16)18-2/h7-8,10,12H,3-6H2,1-2H3/t10-,12-/m1/s1
InChIKey AWXYPPPQFIMDRI-ZYHUDNBSSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNxTthw9Lkc
Name 1,2-Naphthalenedicarboxylic acid, 1,5,6,7,8,8a-hexahydro-, dimethyl ester, trans-(.+-.)-
CAS Registry Number 130487-11-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O4
InChI InChI=1S/C14H18O4/c1-17-13(15)11-8-7-9-5-3-4-6-10(9)12(11)14(16)18-2/h7-8,10,12H,3-6H2,1-2H3/t10-,12-/m1/s1
InChIKey AWXYPPPQFIMDRI-ZYHUDNBSSA-N
Molecular Weight 250.294 g/mol
SMILES C=1([C@@]([C@@]2(CCCCC2=CC1)[H])(C(=O)OC)[H])C(=O)OC
SPLASH splash10-0a59-2900000000-f56fc350f64e16aab8bf
Source of Spectrum H-73-648-23
Synonyms Dimethyl (1R,8aS)-1,5,6,7,8,8a-hexahydro-1,2-naphthalenedicarboxylate Dimethyl (4aRS,5SR)-1,2,3,4,4a,5-hexahydronaphthalene-5,6-dicarboxylate
Wiley ID 1253331