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11,12-Diacetoxyabieta-6,8,11,13-tetraene
SpectraBase Compound ID 7TXjAwDbCIP
InChI InChI=1S/C24H32O4/c1-14(2)16-11-15-7-8-19-23(3,4)9-6-10-24(19,5)22(15)18(13-21(27)28)17(16)12-20(25)26/h7-8,11,14,19H,6,9-10,12-13H2,1-5H3,(H,25,26)(H,27,28)/t19?,24-/m0/s1
InChIKey HRGROJXLLQLMPN-WIIYFNMSSA-N
Mol Weight 384.5 g/mol
Molecular Formula C24H32O4
Exact Mass 384.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKNmlwDtjOT
Name 11,12-Diacetoxyabieta-6,8,11,13-tetraene
Alternate Name(s) [11-(carboxymethyl)abieta-6,8,11,13-tetraen-12-yl]acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O4
InChI InChI=1S/C24H32O4/c1-14(2)16-11-15-7-8-19-23(3,4)9-6-10-24(19,5)22(15)18(13-21(27)28)17(16)12-20(25)26/h7-8,11,14,19H,6,9-10,12-13H2,1-5H3,(H,25,26)(H,27,28)/t19?,24-/m0/s1
InChIKey HRGROJXLLQLMPN-WIIYFNMSSA-N
Molecular Weight 384.516 g/mol
SMILES OC(Cc1c(cc2C=CC3[C@@](c2c1CC(=O)O)(CCCC3(C)C)C)C(C)C)=O
SPLASH splash10-0f6x-0019000000-71bb038ba3d0ee659081
Source of Spectrum J-59-5452-30
Wiley ID 1361818