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(1R,2R,3R,6S,7R,10S)-10-Isopropyl-7-methyltricyclo[5.3.0.0(2,6)]-3-decan-3-spiro-2'-oxiran-6-yl Benzoate
SpectraBase Compound ID 8ixFSgWPurD
InChI InChI=1S/C22H28O3/c1-14(2)16-9-10-20(3)17(16)18-21(13-24-21)11-12-22(18,20)25-19(23)15-7-5-4-6-8-15/h4-8,14,16-18H,9-13H2,1-3H3/t16-,17+,18+,20+,21-,22-/m0/s1
InChIKey CYIXMYYUXQSZJI-WQMAJOMYSA-N
Mol Weight 340.46 g/mol
Molecular Formula C22H28O3
Exact Mass 340.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3h3WXgkCVo
Name (1R,2R,3R,6S,7R,10S)-10-Isopropyl-7-methyltricyclo[5.3.0.0(2,6)]-3-decan-3-spiro-2'-oxiran-6-yl Benzoate
CAS Registry Number 142896-02-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O3
InChI InChI=1S/C22H28O3/c1-14(2)16-9-10-20(3)17(16)18-21(13-24-21)11-12-22(18,20)25-19(23)15-7-5-4-6-8-15/h4-8,14,16-18H,9-13H2,1-3H3/t16-,17+,18+,20+,21-,22-/m0/s1
InChIKey CYIXMYYUXQSZJI-WQMAJOMYSA-N
Molecular Weight 340.463 g/mol
SMILES [C@]12([C@@]3(CC[C@]([C@@]3([C@@]2([C@]2(OC2)CC1)[H])[H])(C(C)C)[H])C)OC(=O)c1ccccc1
SPLASH splash10-0a4i-3900000000-e1496fdd0f81787e4387
Source of Spectrum J-57-5375-0
Synonyms (1'R,2R,2'S,6'S,7'R,10'S)-7'-methyl-10'-(propan-2-yl)spiro[oxirane-2,3'-tricyclo[5.3.0.0(2,6)]decane]-6'-yl benzoate
Wiley ID 1335563