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8'-(Phenylmenthyl) 3-hydroxy-3-(2'-furyl)-2-methylenepropanoate
SpectraBase Compound ID 6wSUkv2fwtq
InChI InChI=1S/C24H30O4/c1-16-12-13-19(24(3,4)18-9-6-5-7-10-18)21(15-16)28-23(26)17(2)22(25)20-11-8-14-27-20/h5-11,14,16,19,21-22,25H,2,12-13,15H2,1,3-4H3/t16-,19+,21+,22?/m0/s1
InChIKey CENZOKSSZVDCNJ-BJLYJODLSA-N
Mol Weight 382.5 g/mol
Molecular Formula C24H30O4
Exact Mass 382.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FhyUfqQzuQR
Name 8'-(Phenylmenthyl) 3-hydroxy-3-(2'-furyl)-2-methylenepropanoate
Comments Computed using HOSE algorithm
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Exact Mass 382.214409442 u
Formula C24H30O4
InChI InChI=1S/C24H30O4/c1-16-12-13-19(24(3,4)18-9-6-5-7-10-18)21(15-16)28-23(26)17(2)22(25)20-11-8-14-27-20/h5-11,14,16,19,21-22,25H,2,12-13,15H2,1,3-4H3/t16-,19+,21+,22?/m0/s1
InChIKey CENZOKSSZVDCNJ-BJLYJODLSA-N
Molecular Weight 382.500 g/mol
SMILES C(C(O[C@]1([C@](C(C=2C=CC=CC2)(C)C)(CC[C@@](C1)(C)[H])[H])[H])=O)(C(C=1OC=CC1)O)=C