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1,4a-dimethyl-1,10-dimethoxycarbonyl-3,7-dihydroxy-8-methylene-gibbane
SpectraBase Compound ID 6qrLzdvyQ15
InChI InChI=1S/C22H32O6/c1-12-8-21-11-22(12,26)7-6-14(21)19(2)9-13(23)10-20(3,18(25)28-5)16(19)15(21)17(24)27-4/h13-16,23,26H,1,6-11H2,2-5H3/t13?,14?,15?,16?,19?,20?,21-,22-/m0/s1
InChIKey WDYXSOSBYMOMNK-RVMXYJGZSA-N
Mol Weight 392.5 g/mol
Molecular Formula C22H32O6
Exact Mass 392.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HpgaBdvveMt
Name 1,4a-dimethyl-1,10-dimethoxycarbonyl-3,7-dihydroxy-8-methylene-gibbane
Alternate Name(s) Dimethyl 3,7-dihydroxy-1,4a-dimethyl-8-methylenegibbane-1,10-dicarboxylate
CAS Registry Number 99221-51-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O6
InChI InChI=1S/C22H32O6/c1-12-8-21-11-22(12,26)7-6-14(21)19(2)9-13(23)10-20(3,18(25)28-5)16(19)15(21)17(24)27-4/h13-16,23,26H,1,6-11H2,2-5H3/t13?,14?,15?,16?,19?,20?,21-,22-/m0/s1
InChIKey WDYXSOSBYMOMNK-RVMXYJGZSA-N
Molecular Weight 392.492 g/mol
SMILES O[C@@]12C[C@]3(C(C4(CC(CC(C4C3C(=O)OC)(C(=O)OC)C)O)C)CC2)CC1=C
SPLASH splash10-0iki-0229000000-980483f715952626874a
Source of Spectrum KC-1985-1150-6
Wiley ID 1365844