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Androstane-3,17-diol-16-(.alpha.-hydroxymethylacetic acid) lactone
SpectraBase Compound ID FkGhnTALeTd
InChI InChI=1S/C22H34O4/c1-21-7-5-13(24)9-12(21)3-4-14-17(21)6-8-22(2)18(14)10-15-16(11-23)20(25)26-19(15)22/h12-19,23-24H,3-11H2,1-2H3
InChIKey NNOPITDERIBTII-UHFFFAOYSA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ircEUbdq8v
Name 2-HYDROXY-9-(HYDROXYMETHYL)-4A,6A-DIMETHYLOCTADECAHYDRO-8H-NAPHTHO[2',1':4,5]INDENO[1,2-B]FURAN-8-ONE
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Exact Mass 362.245709571 u
Formula C22H34O4
InChI InChI=1S/C22H34O4/c1-21-7-5-13(24)9-12(21)3-4-14-17(21)6-8-22(2)18(14)10-15-16(11-23)20(25)26-19(15)22/h12-19,23-24H,3-11H2,1-2H3
InChIKey NNOPITDERIBTII-UHFFFAOYSA-N
Molecular Weight 362.510 g/mol
Nominal Mass 362 u
Number of Peaks 309
SMILES OCC1C(OC2C1CC1C2(CCC2C1CCC1C2(CCC(C1)O)C)C)=O
SPLASH splash10-0006-6974000000-383783cdfbfeba4f49e3
Source File Reference LMCM-88226-502Z
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms 16-hydroxy-5-(hydroxymethyl)-9,13-dimethyl-7-oxapentacyclo[10.8.0.0(2,9).0(4,8).0(13,18)]icosan-6-one
Wiley ID 8_12934