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(1S,4R,5R,7R,9R,10R,13R,14R)-14-formyl-7-hydroxy-9-methyltetracyclo[11.2.1.0(1,10).0(4,9)]hexadecane-5-carboxylic acid
SpectraBase Compound ID JGDosAVObjn
InChI InChI=1S/C19H28O4/c1-18-9-13(21)6-14(17(22)23)15(18)4-5-19-7-11(2-3-16(18)19)12(8-19)10-20/h10-16,21H,2-9H2,1H3,(H,22,23)/t11-,12+,13-,14-,15-,16+,18-,19+/m1/s1
InChIKey ZIYOPAJORMZIKJ-VDSJATKQSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1SslzHn4fA
Name (1S,4R,5R,7R,9R,10R,13R,14R)-14-formyl-7-hydroxy-9-methyltetracyclo[11.2.1.0(1,10).0(4,9)]hexadecane-5-carboxylic acid
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Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-18-9-13(21)6-14(17(22)23)15(18)4-5-19-7-11(2-3-16(18)19)12(8-19)10-20/h10-16,21H,2-9H2,1H3,(H,22,23)/t11-,12+,13-,14-,15-,16+,18-,19+/m1/s1
InChIKey ZIYOPAJORMZIKJ-VDSJATKQSA-N
Instrument Name JEOL JMS-01-SG-2
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290060506
Molecular Weight 320.429 g/mol
SMILES OC([C@]1([C@@]2([C@@](C[C@@](C1)(O)[H])([C@]1([C@@]3(CC2)C[C@@](CC1)([C@@](C3)(C=O)[H])[H])[H])C)[H])[H])=O
SPLASH splash10-0nmi-2595000000-681ba38a82cb4cb35f58
Source of Spectrum RCM-6-342-5
Wiley ID 1835558