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1,4-Naphthalenediol, 2-methyl-3-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-, diacetate
SpectraBase Compound ID Fh5OPhA8mh2
InChI InChI=1S/C30H38O4/c1-20(2)12-10-13-21(3)14-11-15-22(4)18-19-26-23(5)29(33-24(6)31)27-16-8-9-17-28(27)30(26)34-25(7)32/h8-9,12,14,16-18H,10-11,13,15,19H2,1-7H3/b21-14+,22-18+
InChIKey LQOXSTKPVFKMOB-SEUYJHDCSA-N
Mol Weight 462.6 g/mol
Molecular Formula C30H38O4
Exact Mass 462.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 65OQOvMLmAr
Name 1,4-Naphthalenediol, 2-methyl-3-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-, diacetate
Alternate Name(s) 4-(Acetyloxy)-2-methyl-3-[(2E,6E)-3,7,11-trimethyl-2,6,10-dodecatrienyl]-1-naphthyl acetate Acetic acid [4-acetyloxy-2-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1-naphthalenyl] ester [4-acetyloxy-2-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]naphthalen-1-yl] acetate [4-acetoxy-2-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1-naphthyl] acetate [4-acetyloxy-2-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]naphthalen-1-yl] ethanoate
CAS Registry Number 56298-82-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H38O4
InChI InChI=1S/C30H38O4/c1-20(2)12-10-13-21(3)14-11-15-22(4)18-19-26-23(5)29(33-24(6)31)27-16-8-9-17-28(27)30(26)34-25(7)32/h8-9,12,14,16-18H,10-11,13,15,19H2,1-7H3/b21-14+,22-18+
InChIKey LQOXSTKPVFKMOB-SEUYJHDCSA-N
Molecular Weight 462.630 g/mol
SMILES CC(=O)Oc1c(C)c(C\C=C/(C)CC\C=C/(C)CCC=C(C)C)c(OC(C)=O)c2ccccc12
SPLASH splash10-004i-3329200000-658a6556b9d04c94d2c2
Source of Spectrum AL-55-598-7
Wiley ID 1391198