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1,4-Naphthalenediol, 2-methyl-3-(3,7,11-trimethyl-2,10-dodecadienyl)-, diacetate
SpectraBase Compound ID I2kMrBFH1sZ
InChI InChI=1S/C30H40O4/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/h8-9,12,16-18,21H,10-11,13-15,19H2,1-7H3/b22-18+
InChIKey FIHIHZYVDNXMAK-RELWKKBWSA-N
Mol Weight 464.6 g/mol
Molecular Formula C30H40O4
Exact Mass 464.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9jO3SYrJgg
Name 1,4-Naphthalenediol, 2-methyl-3-(3,7,11-trimethyl-2,10-dodecadienyl)-, diacetate
Alternate Name(s) 4-(acetyloxy)-2-methyl-3-[(2E)-3,7,11-trimethyl-2,10-dodecadienyl]-1-naphthyl acetate Ii-dihydromenaquinol-3 diacetate
CAS Registry Number 56298-81-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40O4
InChI InChI=1S/C30H40O4/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/h8-9,12,16-18,21H,10-11,13-15,19H2,1-7H3/b22-18+
InChIKey FIHIHZYVDNXMAK-RELWKKBWSA-N
Molecular Weight 464.646 g/mol
SMILES c1(c(c(C)c(c2c1cccc2)OC(=O)C)C\C=C\(CCCC(CCC=C(C)C)C)C)OC(=O)C
SPLASH splash10-001r-4619400000-40b7a305fcdb2c7b6a57
Source of Spectrum AL-55-598-8
Wiley ID 1391630