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1-[2,3,6-trimethyl-4-oxidanyl-5-[(1S)-1-phenylbutyl]phenyl]ethanone
SpectraBase Compound ID B2uikJarYBo
InChI InChI=1S/C21H26O2/c1-6-10-18(17-11-8-7-9-12-17)20-15(4)19(16(5)22)13(2)14(3)21(20)23/h7-9,11-12,18,23H,6,10H2,1-5H3/t18-/m0/s1
InChIKey HEOJHLAQCNMZSH-SFHVURJKSA-N
Mol Weight 310.44 g/mol
Molecular Formula C21H26O2
Exact Mass 310.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qZT5tvkP8B
Name 1-[2,3,6-trimethyl-4-oxidanyl-5-[(1S)-1-phenylbutyl]phenyl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O2
InChI InChI=1S/C21H26O2/c1-6-10-18(17-11-8-7-9-12-17)20-15(4)19(16(5)22)13(2)14(3)21(20)23/h7-9,11-12,18,23H,6,10H2,1-5H3/t18-/m0/s1
InChIKey HEOJHLAQCNMZSH-SFHVURJKSA-N
Molecular Weight 310.437 g/mol
SMILES Oc1c(c(c(c(C)c1C)C(=O)C)C)[C@](c1ccccc1)(CCC)[H]
SPLASH splash10-02ta-0094000000-1f0563a554c0190bfb20
Source of Spectrum KC-0-1025-16
Wiley ID 785579