SpectraBase Spectrum ID |
H3L3ekIx5tc |
Name |
Pinanediol |
CAS Registry Number |
18680-27-8 |
Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
170.130679818 u |
Formula |
C10H18O2 |
InChI |
InChI=1S/C10H18O2/c1-9(2)6-4-7(9)10(3,12)8(11)5-6/h6-8,11-12H,4-5H2,1-3H3/t6-,7-,8?,10-/m0/s1 |
InChIKey |
MOILFCKRQFQVFS-ABZRCEQJSA-N |
Molecular Weight |
170.252 g/mol |
Number of Peaks |
50 |
RI1 |
1321 |
SMILES |
OC1C[C@]2(C([C@@]([C@]1(C)O)(C2)[H])(C)C)[H] |
SPLASH |
splash10-0006-9100000000-b036a6e56ea55922013c |
Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
Synonyms |
Bicyclo[3.1.1]heptane-2,3-diol, 2,6,6-trimethyl- |
Wiley ID |
LM_FFNSC3_2651 |