Spektraris NMR
4-hydroxy-7-methylindan-1-one
Common Name: 4-hydroxy-7-methylindan-1-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C10H10O2/c1-6-2-4-8(11)7-3-5-9(12)10(6)7/h2,4,11H,3,5H2,1H3
InChIKey: InChIKey=LQCJCAYSGRFFCU-UHFFFAOYSA-N
Formula: C10H10O2
Molecular Weight: 162.185576
Exact Mass: 162.06808
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Jaki, B., Heilmann, J., Sticher, O. J Nat Prod (2000) 63, 1283-5
Species:
Notes: Family : Aromatics, Type : Indanes; 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) | 207.4 |
| 2 (CH2) | 33.4 |
| 3 (CH2) | 31.3 |
| 4 (C) | 117.6 |
| 5 (C) | 162.3 |
| 6 (CH) | 118.7 |
| 7 (CH) | 136.2 |
| 8 (C) | 129.2 |
| 9 (C) | 143.2 |
| 8a (CH3) | 18.1 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.