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4-((1R,2S,5R,8S)-4,4,8-Trimethyl-tricyclo[6.3.1.0*2,5*]dodec-1-yl)-benzene-1,3-diol
SpectraBase Compound ID 5KiISP0kz7g
InChI InChI=1S/C21H30O2/c1-19(2)12-17-15(19)7-10-20(3)8-4-9-21(17,13-20)16-6-5-14(22)11-18(16)23/h5-6,11,15,17,22-23H,4,7-10,12-13H2,1-3H3/t15-,17+,20+,21+/m1/s1
InChIKey ZEPDSEBKMYXSOF-GWKIZSTFSA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HysXuboak8
Name 4-((1R,2S,5R,8S)-4,4,8-Trimethyl-tricyclo[6.3.1.0*2,5*]dodec-1-yl)-benzene-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O2
InChI InChI=1S/C21H30O2/c1-19(2)12-17-15(19)7-10-20(3)8-4-9-21(17,13-20)16-6-5-14(22)11-18(16)23/h5-6,11,15,17,22-23H,4,7-10,12-13H2,1-3H3/t15-,17+,20+,21+/m1/s1
InChIKey ZEPDSEBKMYXSOF-GWKIZSTFSA-N
Molecular Weight 314.469 g/mol
SMILES Oc1ccc(c(c1)O)[C@]12[C@@]3([C@](CC[C@](C2)(C)CCC1)([H])C(C3)(C)C)[H]
SPLASH splash10-0udi-1392000000-1ebc9fbb464b720acfc5
Source of Spectrum H-84-3486-20
Synonyms 4-(4',4',8'-Trimethyltricyclo[6.3.1.0(2,5)]dodec-1'-yl)-benzene-1,3-diol 4-[(1R,2S,5R,8S)-4,4,8-trimethyltricyclo[6.3.1.0(2,5)]dodec-1-yl]-1,3-benzenediol
Wiley ID 847923