SpectraBase Spectrum ID |
9W1ge0ynW7N |
Name |
Debromofiliformin |
CAS Registry Number |
139238-06-5 |
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 |
216.151415263 u |
Formula |
C15H20O |
InChI |
InChI=1S/C15H20O/c1-10-5-6-12-13(9-10)16-15(4)8-7-14(12,3)11(15)2/h5-6,9,11H,7-8H2,1-4H3/t11-,14-,15+/m0/s1 |
InChIKey |
KTFYXLCHBBZWNO-TUKIKUTGSA-N |
Molecular Weight |
216.324 g/mol |
Number of Peaks |
50 |
RI1 |
1598 |
RI2 |
1271 |
SMILES |
c12c(cc(cc2)C)O[C@@]2(CC[C@]1([C@@]2(C)[H])C)C |
SPLASH |
splash10-0fxt-2930000000-a3ce67fa027bf8d9c31d |
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 |
2,5-Methano -1-benzoxepin, 2, 3,4,5-tetrahydro-2, 5,8,10-tetramethyl-, (2R,5S,10S)-rel- |
Wiley ID |
LM_FFNSC3_1986 |