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1,2,9-Trimethyl-9-oxo-1-(2',5'-dihydroxybenzyl)-perhydro-naphthalene
SpectraBase Compound ID Le4ymak23nk
InChI InChI=1S/C24H32O5/c1-15-11-12-23(4)21(7-6-8-22(23)27)24(15,5)14-18-13-19(28-16(2)25)9-10-20(18)29-17(3)26/h9-10,13,15,21H,6-8,11-12,14H2,1-5H3/t15-,21+,23-,24+/m0/s1
InChIKey KNBUNVXRPAOJAC-IPSSNNEBSA-N
Mol Weight 400.5 g/mol
Molecular Formula C24H32O5
Exact Mass 400.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VQkvrivPwj
Name 1,2,9-Trimethyl-9-oxo-1-(2',5'-dihydroxybenzyl)-perhydro-naphthalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O5
InChI InChI=1S/C24H32O5/c1-15-11-12-23(4)21(7-6-8-22(23)27)24(15,5)14-18-13-19(28-16(2)25)9-10-20(18)29-17(3)26/h9-10,13,15,21H,6-8,11-12,14H2,1-5H3/t15-,21+,23-,24+/m0/s1
InChIKey KNBUNVXRPAOJAC-IPSSNNEBSA-N
Molecular Weight 400.515 g/mol
SMILES [C@]1([C@]2([C@](C(=O)CCC2)(C)CC[C@@]1(C)[H])[H])(Cc1c(OC(=O)C)ccc(OC(=O)C)c1)C
SPLASH splash10-0006-0900000000-4a4a633cc433c6ad0cda
Source of Spectrum X4-26-298-0
Wiley ID 1586260