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2-Acetoxyglycerol 2,5,5,8a-Tetramethyl-1,4,5,6,7,8-hexahydronaphthalene-1-carboxylate
SpectraBase Compound ID JIMmv6UuUB5
InChI InChI=1S/C20H32O5/c1-13-7-8-16-19(3,4)9-6-10-20(16,5)17(13)18(23)24-12-15(11-21)25-14(2)22/h7,15-17,21H,6,8-12H2,1-5H3/t15-,16?,17+,20-/m0/s1
InChIKey KCTSCYVGDGWYTO-CJVFLTLBSA-N
Mol Weight 352.5 g/mol
Molecular Formula C20H32O5
Exact Mass 352.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51fKRMBcDQ
Name 2-Acetoxyglycerol 2,5,5,8a-Tetramethyl-1,4,5,6,7,8-hexahydronaphthalene-1-carboxylate
Alternate Name(s) (S)-2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-naphthalene-1-carboxylic acid 2-acetoxy-3-hydroxy-propyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O5
InChI InChI=1S/C20H32O5/c1-13-7-8-16-19(3,4)9-6-10-20(16,5)17(13)18(23)24-12-15(11-21)25-14(2)22/h7,15-17,21H,6,8-12H2,1-5H3/t15-,16?,17+,20-/m0/s1
InChIKey KCTSCYVGDGWYTO-CJVFLTLBSA-N
Molecular Weight 352.471 g/mol
SMILES OC[C@](OC(=O)C)(COC([C@@]1([C@@]2(C(CC=C1C)C(C)(C)CCC2)C)[H])=O)[H]
SPLASH splash10-0lmm-0940000000-84e66d3d5e4122b51ba0
Source of Spectrum QC-10-1272-2n
Wiley ID 871288