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4-Hydroperoxy-18-nor-abietane
SpectraBase Compound ID GhlVs8VyrkX
InChI InChI=1S/C19H28O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-18(16,3)10-5-11-19(17,4)21-20/h6,8,12-13,17,20H,5,7,9-11H2,1-4H3/t17-,18-,19-/m1/s1
InChIKey SERPESJFVFFAKV-GUDVDZBRSA-N
Mol Weight 288.43 g/mol
Molecular Formula C19H28O2
Exact Mass 288.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I1d7NTTGCpD
Name 4-Hydroperoxy-18-nor-abietane
Alternate Name(s) (1R,4aS,10aR)-7-Isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydro-phenanthren-1-yl-hydroperoxide
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Formula C19H28O2
InChI InChI=1S/C19H28O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-18(16,3)10-5-11-19(17,4)21-20/h6,8,12-13,17,20H,5,7,9-11H2,1-4H3/t17-,18-,19-/m1/s1
InChIKey SERPESJFVFFAKV-GUDVDZBRSA-N
Molecular Weight 288.431 g/mol
SMILES OO[C@]1([C@]2([C@@](c3c(cc(cc3)C(C)C)CC2)(CCC1)C)[H])C
SPLASH splash10-00dr-0940000000-1d6624a0e4ef15c716a8
Source of Spectrum F-50-2597-6
Wiley ID 1292129