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Totarol acetate

View entire compound with spectra: 1 NMR, and 4 MS (GC)

Totarol acetate <trans->
SpectraBase Compound ID HquvnIyh1X2
InChI InChI=1S/C22H32O2/c1-14(2)20-16-8-11-19-21(4,5)12-7-13-22(19,6)17(16)9-10-18(20)24-15(3)23/h9-10,14,19H,7-8,11-13H2,1-6H3
InChIKey ORVBSFQTFRBNRP-UHFFFAOYSA-N
Mol Weight 328.5 g/mol
Molecular Formula C22H32O2
Exact Mass 328.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7vAiwZ0b4Tf
Name 2-Phenanthrenol, 4b,5,6,7,8,8a,9,10-octahydro-4b,8,8-trimethyl-1-(1-methylethyl)-, acetate, (4bS-trans)-
CAS Registry Number 15340-82-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O2
InChI InChI=1S/C22H32O2/c1-14(2)20-16-8-11-19-21(4,5)12-7-13-22(19,6)17(16)9-10-18(20)24-15(3)23/h9-10,14,19H,7-8,11-13H2,1-6H3
InChIKey ORVBSFQTFRBNRP-UHFFFAOYSA-N
Molecular Weight 328.496 g/mol
SMILES CC(C)c1c(ccc2c1CCC1C(C)(C)CCCC21C)OC(C)=O
SPLASH splash10-00dr-2490000000-78eef7b2371022374e89
Source of Spectrum T-67-4345-0
Synonyms 14-Isopropylpodocarpa-8,11,13-trien-13-yl acetate (1-isopropyl-4b,8,8-trimethyl-5,6,7,8a,9,10-hexahydrophenanthren-2-yl) acetate (4b,8,8-trimethyl-1-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-2-yl) acetate (4b,8,8-trimethyl-1-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-2-yl) ethanoate Acetic acid (1-isopropyl-4b,8,8-trimethyl-5,6,7,8a,9,10-hexahydrophenanthren-2-yl) ester Acetic acid (4b,8,8-trimethyl-1-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-2-yl) ester Podocarpa-8,11,13-trien-13-ol, 14-isopropyl-, acetate Totarol acetate Totaryl acetate
Wiley ID 49043