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[(3aS,7aS)-7a-(3-Methoxy-phenyl)-octahydro-indol-1-yl]-acetic acid ethyl ester
SpectraBase Compound ID DSbVarS7Qhn
InChI InChI=1S/C19H27NO3/c1-3-23-18(21)14-20-12-10-15-7-4-5-11-19(15,20)16-8-6-9-17(13-16)22-2/h6,8-9,13,15H,3-5,7,10-12,14H2,1-2H3/t15-,19-/m0/s1
InChIKey VEVKZLACXCFLPC-KXBFYZLASA-N
Mol Weight 317.43 g/mol
Molecular Formula C19H27NO3
Exact Mass 317.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FvaU0fQB2yq
Name [(3aS,7aS)-7a-(3-Methoxy-phenyl)-octahydro-indol-1-yl]-acetic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO3
InChI InChI=1S/C19H27NO3/c1-3-23-18(21)14-20-12-10-15-7-4-5-11-19(15,20)16-8-6-9-17(13-16)22-2/h6,8-9,13,15H,3-5,7,10-12,14H2,1-2H3/t15-,19-/m0/s1
InChIKey VEVKZLACXCFLPC-KXBFYZLASA-N
Molecular Weight 317.429 g/mol
SMILES [C@@]12(N(CC[C@@]2(CCCC1)[H])CC(=O)OCC)c1cc(OC)ccc1
SPLASH splash10-00kf-0094000000-a112532af11f59a0044f
Source of Spectrum AH-135-966-3
Synonyms Ethyl[(3aS,7aS)-7a-(3-methoxyphenyl)octahydro-1H-indol-1-yl]acetate Ethyl[7a-(3'-methoxyphenyl)-octahydroindol-1'-yl]acetate
Wiley ID 1576602