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1-Hydroxycaryolane-9-.beta.-yl acetate
SpectraBase Compound ID 1Q35Ja07UQe
InChI InChI=1S/C17H28O3/c1-11(18)20-14-6-8-17(19)10-16(14,4)7-5-12-13(17)9-15(12,2)3/h12-14,19H,5-10H2,1-4H3/t12-,13+,14?,16+,17-/m1/s1
InChIKey LRFYCTLMXJJJHZ-NNEPTKMSSA-N
Mol Weight 280.41 g/mol
Molecular Formula C17H28O3
Exact Mass 280.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 31i57CWPUu
Name 1-Hydroxycaryolane-9-.beta.-yl acetate
Alternate Name(s) (1R,2S,5R,8S)-1-hydroxy-4,4,8-trimethyltricyclo[6.3.1.0(2,5)]dodec-9-yl acetate
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Formula C17H28O3
InChI InChI=1S/C17H28O3/c1-11(18)20-14-6-8-17(19)10-16(14,4)7-5-12-13(17)9-15(12,2)3/h12-14,19H,5-10H2,1-4H3/t12-,13+,14?,16+,17-/m1/s1
InChIKey LRFYCTLMXJJJHZ-NNEPTKMSSA-N
Molecular Weight 280.408 g/mol
SMILES O[C@]12[C@@]3([C@](CC[C@](C2)(C)C(CC1)OC(=O)C)([H])C(C3)(C)C)[H]
SPLASH splash10-0nt9-0950000000-8a8ed525f5652b96b1a4
Source of Spectrum E1-42-145-12
Wiley ID 1552387