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(1R*,4S*,6R*)-4-(Acetyloxy)-6-[3-(acetyloxy)-1,5-dimethylhex-4-enyl]-3-methylcyclohex-2-en-1-yl (2Z)-2-Methylbut-2-enoate
SpectraBase Compound ID 3papIRENdiV
InChI InChI=1S/C24H38O6/c1-9-15(4)24(27)30-23-12-17(6)22(29-19(8)26)13-21(23)16(5)11-20(10-14(2)3)28-18(7)25/h9-10,12,16,20-24,27H,11,13H2,1-8H3/b15-9-/t16?,20?,21-,22+,23+,24?/m0/s1
InChIKey GAZFXPBGKVQKSI-CLBLKSKLSA-N
Mol Weight 422.6 g/mol
Molecular Formula C24H38O6
Exact Mass 422.266839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cpeFcVpEf1
Name (1R*,4S*,6R*)-4-(Acetyloxy)-6-[3-(acetyloxy)-1,5-dimethylhex-4-enyl]-3-methylcyclohex-2-en-1-yl (2Z)-2-Methylbut-2-enoate
Alternate Name(s) (1R*,4S*,6R*)-4,9-Bis(acetyloxy)-1-{[(2Z)-2-methylbut-2-enoyl]oxy}bisabol-2(3),10(11)-diene (6S)-6-((1S,2S,5R)-5-acetoxy-2-(((Z)-1-hydroxy-2-methylbut-2-en-1-yl)oxy)-4-methylcyclohex-3-en-1-yl)-2-methylhept-2-en-4-yl acetate (6R)-6-((1RS,2RS,5SR)-5-acetoxy-2-(((Z)-1-hydroxy-2-methylbut-2-en-1-yl)oxy)-4-methylcyclohex-3-en-1-yl)-2-methylhept-2-en-4-yl acetate
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Formula C24H38O6
InChI InChI=1S/C24H38O6/c1-9-15(4)24(27)30-23-12-17(6)22(29-19(8)26)13-21(23)16(5)11-20(10-14(2)3)28-18(7)25/h9-10,12,16,20-24,27H,11,13H2,1-8H3/b15-9-/t16?,20?,21-,22+,23+,24?/m0/s1
InChIKey GAZFXPBGKVQKSI-CLBLKSKLSA-N
Literature Reference DOI 10.1002_1522-2675(200209)85_9_2982
Molecular Weight 422.562 g/mol
SMILES OC(O[C@@]1(C=C([C@](OC(C)=O)(C[C@]1(C(C)CC(OC(C)=O)C=C(C)C)[H])[H])C)[H])\C(C)=C/C
SPLASH splash10-067i-4940000000-123d02f71ec7b124b16a
Source of Spectrum H-85-2987-2
Wiley ID 1787583