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(2S,3R)-4-Benzyloxy-3-methyl-2-((1S)-1-methyl-2-cyclohexenylbutanoic acid
SpectraBase Compound ID 4DPT09QZlWc
InChI InChI=1S/C19H26O3/c1-15(13-22-14-16-9-5-3-6-10-16)17(18(20)21)19(2)11-7-4-8-12-19/h3,5-7,9-11,15,17H,4,8,12-14H2,1-2H3,(H,20,21)/t15-,17+,19+/m0/s1
InChIKey YTWYTRNXDNKEGR-KVSKMBFKSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1N8iBZhF5UM
Name (2S,3R)-4-Benzyloxy-3-methyl-2-((1S)-1-methyl-2-cyclohexenylbutanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-15(13-22-14-16-9-5-3-6-10-16)17(18(20)21)19(2)11-7-4-8-12-19/h3,5-7,9-11,15,17H,4,8,12-14H2,1-2H3,(H,20,21)/t15-,17+,19+/m0/s1
InChIKey YTWYTRNXDNKEGR-KVSKMBFKSA-N
Molecular Weight 302.414 g/mol
SMILES OC([C@]([C@@]1(C=CCCC1)C)([C@](COCc1ccccc1)(C)[H])[H])=O
SPLASH splash10-0007-9100000000-8f652c9bd1f935eddfe4
Source of Spectrum F2-42-3551-29
Synonyms (2S,3R)-3-methyl-2-[(1S)-1-methyl-1-cyclohex-2-enyl]-4-phenylmethoxybutanoic acid (2S,3R)-3-methyl-2-[(1S)-1-methylcyclohex-2-en-1-yl]-4-phenylmethoxybutanoic acid (2S,3R)-4-benzyloxy-3-methyl-2-[(1S)-1-methylcyclohex-2-en-1-yl]butanoic acid (2S,3R)-3-methyl-2-[(1S)-1-methylcyclohex-2-en-1-yl]-4-phenylmethoxy-butanoic acid
Wiley ID 1600338