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[(1S)-2,2,4-trimethylcyclohex-3-en-1-yl]methyl acetate
SpectraBase Compound ID DRqM6EvwGvp
InChI InChI=1S/C12H20O2/c1-9-5-6-11(8-14-10(2)13)12(3,4)7-9/h7,11H,5-6,8H2,1-4H3/t11-/m1/s1
InChIKey BXGBHMMYDWACGQ-LLVKDONJSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJcqS08vTp3
Name [(1S)-2,2,4-trimethylcyclohex-3-en-1-yl]methyl acetate
CAS Registry Number 127075-63-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-9-5-6-11(8-14-10(2)13)12(3,4)7-9/h7,11H,5-6,8H2,1-4H3/t11-/m1/s1
InChIKey BXGBHMMYDWACGQ-LLVKDONJSA-N
Molecular Weight 196.290 g/mol
SMILES C1(C=C(C)CC[C@@]1(COC(=O)C)[H])(C)C
SPLASH splash10-006x-9500000000-3cfe96229e82aa1a26cd
Source of Spectrum H-72-1519-0
Synonyms [(1S)-2,2,4-trimethylcyclohex-3-en-1-yl]methyl ethanoate Acetic acid [(1S)-2,2,4-trimethyl-1-cyclohex-3-enyl]methyl ester
Wiley ID 1193611