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1H-Inden-5-ol, 2,3,5,6,7,7a-hexahydro-7a-(2-methoxyethyl)-1-methyl-, benzoate, [1R-(1.alpha.,5.alpha.,7a.beta.)]-
SpectraBase Compound ID KSXiYlIbf7G
InChI InChI=1S/C20H26O3/c1-15-8-9-17-14-18(10-11-20(15,17)12-13-22-2)23-19(21)16-6-4-3-5-7-16/h3-7,14-15,18H,8-13H2,1-2H3/t15-,18-,20+/m1/s1
InChIKey LJRJPSVUQZXQTG-ZTNFWEORSA-N
Mol Weight 314.43 g/mol
Molecular Formula C20H26O3
Exact Mass 314.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pqlzaikE7Q
Name 1H-Inden-5-ol, 2,3,5,6,7,7a-hexahydro-7a-(2-methoxyethyl)-1-methyl-, benzoate, [1R-(1.alpha.,5.alpha.,7a.beta.)]-
Alternate Name(s) (1R,5R,7aS)-7a-(2-methoxyethyl)-1-methyl-2,3,5,6,7,7a-hexahydro-1H-inden-5-yl benzoate (1R,5R-7as)-7a-methoxyethyl-1-methyl-5,6,7,7a-tetrahydrindan-5-yl benzoate
CAS Registry Number 128790-42-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O3
InChI InChI=1S/C20H26O3/c1-15-8-9-17-14-18(10-11-20(15,17)12-13-22-2)23-19(21)16-6-4-3-5-7-16/h3-7,14-15,18H,8-13H2,1-2H3/t15-,18-,20+/m1/s1
InChIKey LJRJPSVUQZXQTG-ZTNFWEORSA-N
Molecular Weight 314.425 g/mol
SMILES C=12[C@](CC[C@@](OC(=O)c3ccccc3)(C1)[H])([C@](C)(CC2)[H])CCOC
SPLASH splash10-0a4l-2900000000-6e54d709911838d8c59d
Source of Spectrum F-46-771-0
Wiley ID 1315425