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PROPIONIC ACID 1-[1-(3-METHOXYMETHOXY-10,13-DIMETHYL-2,3,4,9,10,11,12,13,14,15,16,17-DODECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-17-YL)-
SpectraBase Compound ID 9g3oAKhOxxO
InChI InChI=1S/C30H46O4/c1-7-9-27(34-28(31)8-2)20(3)24-12-13-25-23-11-10-21-18-22(33-19-32-6)14-16-29(21,4)26(23)15-17-30(24,25)5/h7,9-11,20,22,24-27H,8,12-19H2,1-6H3/b9-7-
InChIKey LYMHJYJICDTQMI-CLFYSBASSA-N
Mol Weight 470.7 g/mol
Molecular Formula C30H46O4
Exact Mass 470.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Zwlk4qE8dG
Name PROPIONIC ACID 1-[1-(3-METHOXYMETHOXY-10,13-DIMETHYL-2,3,4,9,10,11,12,13,14,15,16,17-DODECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-17-YL)-
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Exact Mass 470.339609957 u
Formula C30H46O4
InChI InChI=1S/C30H46O4/c1-7-9-27(34-28(31)8-2)20(3)24-12-13-25-23-11-10-21-18-22(33-19-32-6)14-16-29(21,4)26(23)15-17-30(24,25)5/h7,9-11,20,22,24-27H,8,12-19H2,1-6H3/b9-7-
InChIKey LYMHJYJICDTQMI-CLFYSBASSA-N
Molecular Weight 470.694 g/mol
Nominal Mass 470 u
Number of Peaks 126
SMILES C(OC)OC1CCC2(C3C(C4C(CC3)(C(CC4)C(C)C(OC(=O)CC)\C=C/C)C)=CC=C2C1)C
SPLASH splash10-0a4i-8833900000-f6e668a70e31e77270f6
Source File Reference LMCM-66928-784X
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms (4Z)-2-[5-(methoxymethoxy)-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadeca-7,9-dien-14-yl]hex-4-en-3-yl propanoate
Wiley ID 8_18667