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3-Buten-2-ol, 2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, acetate, (E)-
SpectraBase Compound ID LHkRGPkONxO
InChI InChI=1S/C16H26O2/c1-12-8-7-10-15(3,4)14(12)9-11-16(5,6)18-13(2)17/h9,11H,7-8,10H2,1-6H3/b11-9+
InChIKey AMCLTIVXXGXFTQ-PKNBQFBNSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FniSIPlOke3
Name 3-Buten-2-ol, 2-methyl-4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, acetate, (E)-
CAS Registry Number 54344-74-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-12-8-7-10-15(3,4)14(12)9-11-16(5,6)18-13(2)17/h9,11H,7-8,10H2,1-6H3/b11-9+
InChIKey AMCLTIVXXGXFTQ-PKNBQFBNSA-N
Molecular Weight 250.382 g/mol
SMILES C1(\C=C\C(OC(=O)C)(C)C)=C(CCCC1(C)C)C
SPLASH splash10-052f-8900000000-113203d02c044f9b1b0c
Source of Spectrum H-57-1123-39
Synonyms (2E)-1,1-dimethyl-3-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2-propenyl acetate 2-Acetoxy-2-methyl-4-(2',6',6'-trimethylcyclohex-1'-en-1'-yl)trans-but-3-ene
Wiley ID 1253891