SpectraBase Spectrum ID |
Bw47sAM4ugS |
Name |
Dihydro agarofuran <4-alfa-hydroxy-> |
CAS Registry Number |
123064-30-2 |
Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
238.193280075 u |
Formula |
C15H26O2 |
InChI |
InChI=1S/C15H26O2/c1-10-6-5-7-14(4)9-12(16)11-8-15(10,14)17-13(11,2)3/h10-12,16H,5-9H2,1-4H3/t10-,11+,12+,14+,15?/m0/s1 |
InChIKey |
MQKICBWQMIBCGG-MEYFJDMRSA-N |
Molecular Weight |
238.371 g/mol |
Number of Peaks |
50 |
RI1 |
1650 |
SMILES |
O[C@@]1(C[C@]2(C)C3(C[C@]1(C(O3)(C)C)[H])[C@@](C)(CCC2)[H])[H] |
SPLASH |
splash10-0006-9410000000-a19b18c8cbdb27bc2cc9 |
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 |
2H-3,9a-Methano-1-benzoxepin-4-ol, octahydro-2,2,5a,9-tetramethyl- |
Wiley ID |
LM_FFNSC3_2197 |