(1R,2S,5R,8S)-2-Methyl-4-(4,4,8-trimethyltricyclo[6.3.1.02,5]dodec-1-yl)phenol

(1R,2S,5R,8S)-2-Methyl-4-(4,4,8-trimethyltricyclo[6.3.1.02,5]dodec-1-yl)phenol

Common Name: (1R,2S,5R,8S)-2-Methyl-4-(4,4,8-trimethyltricyclo[6.3.1.02,5]dodec-1-yl)phenol

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C22H32O2/c1-15-12-16(6-7-19(15)23)24-22-10-5-9-21(4,14-22)11-8-17-18(22)13-20(17,2)3/h6-7,12,17-18,23H,5,8-11,13-14H2,1-4H3/t17-,18+,21-,22+/m1/s1

InChIKey: InChIKey=UOJXORRGMGJBAD-OSZJIOELSA-N

Formula: C22H32O2

Molecular Weight: 328.489104

Exact Mass: 328.24023

NMR Solvent: T+C

MHz:

Calibration:

NMR references: 13C - Fomenko, V.V., Korchagina, D.V., Salakhutdinov, N.F., Barkhash, V.A. Helv Chim Acta (2001) 84, 3477-87

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Caryolanes; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)

Carbon NMR Peaks

Position PPM
1 (C) 39.7
2 (CH) 40.56
3 (CH2) 39.05
4 (C) 34.06
5 (CH) 46.12
6 (CH2) 22.8
7 (CH2) 37.79
8 (C) 34.09
9 (CH2) 38.1
10 (CH2) 20.02
11 (CH2) 37.88
12 (CH2) 45.02
13 (CH3) 20.99
14 (CH3) 30.52
15 (CH3) 34.68
1a (C) 141.64
1b (CH) 128.68
1c (C) 122.43
1d (C) 151.09
1e (CH) 114.09
1f (CH) 124.52
1ca (CH3) 16.21