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(4aR,6R,8aR)-1,1,3,6-tetramethyl-4a,5,6,7,8,8a-hexahydro-2-benzopyran-4-carboxylic acid methyl ester
SpectraBase Compound ID 40egteWwWdb
InChI InChI=1S/C15H24O3/c1-9-6-7-12-11(8-9)13(14(16)17-5)10(2)18-15(12,3)4/h9,11-12H,6-8H2,1-5H3/t9-,11-,12-/m1/s1
InChIKey BTQXCHDNAGGFHH-YUSALJHKSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmvDjLSqh59
Name (4aR,6R,8aR)-1,1,3,6-tetramethyl-4a,5,6,7,8,8a-hexahydro-2-benzopyran-4-carboxylic acid methyl ester
CAS Registry Number 120229-99-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-9-6-7-12-11(8-9)13(14(16)17-5)10(2)18-15(12,3)4/h9,11-12H,6-8H2,1-5H3/t9-,11-,12-/m1/s1
InChIKey BTQXCHDNAGGFHH-YUSALJHKSA-N
Molecular Weight 252.354 g/mol
SMILES C1(=C(OC([C@]2([C@]1(C[C@@](CC2)(C)[H])[H])[H])(C)C)C)C(=O)OC
SPLASH splash10-000f-9730000000-2678d4a1249667a0bacb
Source of Spectrum J-54-3129-17
Synonyms (4aR,6R,8aR)-1,1,3,6-tetramethyl-4a,5,6,7,8,8a-hexahydroisochromene-4-carboxylic acid methyl ester Methyl (4aR,6R,8aR)-1,1,3,6-tetramethyl-4a,5,6,7,8,8a-hexahydroisochromene-4-carboxylate
Wiley ID 1255900