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Acetic acid, 6,6-dimethyl-9-methylene-3-pentyl-1-(tetrahydropyran-2-yloxy)-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-8-yl ester
SpectraBase Compound ID Ae6G6g3it1m
InChI InChI=1S/C28H40O5/c1-6-7-8-11-20-15-24(32-26-12-9-10-13-30-26)27-21-14-18(2)23(31-19(3)29)17-22(21)28(4,5)33-25(27)16-20/h15-16,21-23,26H,2,6-14,17H2,1,3-5H3
InChIKey JLTPAEXBTWJGQK-UHFFFAOYSA-N
Mol Weight 456.6 g/mol
Molecular Formula C28H40O5
Exact Mass 456.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKNf83DwzpC
Name Acetic acid, 6,6-dimethyl-9-methylene-3-pentyl-1-(tetrahydropyran-2-yloxy)-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-8-yl ester
CAS Registry Number 52493-17-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H40O5
InChI InChI=1S/C28H40O5/c1-6-7-8-11-20-15-24(32-26-12-9-10-13-30-26)27-21-14-18(2)23(31-19(3)29)17-22(21)28(4,5)33-25(27)16-20/h15-16,21-23,26H,2,6-14,17H2,1,3-5H3
InChIKey JLTPAEXBTWJGQK-UHFFFAOYSA-N
Molecular Weight 456.623 g/mol
SMILES CC1(Oc2c(c(cc(CCCCC)c2)OC2CCCCO2)C2C1CC(C(C2)=C)OC(=O)C)C
SPLASH splash10-0231-7597000000-f5d0dc81672208938bc5
Synonyms (6,6-dimethyl-9-methylene-3-pentyl-1-tetrahydropyran-2-yloxy-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-8-yl) acetate 6,6-Dimethyl-9-methylene-3-pentyl-1-(tetrahydro-2H-pyran-2-yloxy)-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-8-yl acetate Acetic acid (3-amyl-6,6-dimethyl-9-methylene-1-tetrahydropyran-2-yloxy-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-8-yl) ester Acetic acid [6,6-dimethyl-9-methylene-1-(2-oxanyloxy)-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c][1]benzopyran-8-yl] ester [6,6-dimethyl-9-methylidene-1-(oxan-2-yloxy)-3-pentyl-7,8,10,10a-tetrahydro-6aH-benzo[c]chromen-8-yl] acetate
Wiley ID 1480104