SpectraBase Compound ID | IsboIuaiMrQ |
---|---|
InChI | InChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h6H,2-5H2,1H3/i8+2 |
InChIKey | LFSAPCRASZRSKS-PPJXEINESA-N |
Mol Weight | 114.17 g/mol |
Molecular Formula | C7H1218O |
Exact Mass | 114.09306 g/mol |
SpectraBase Spectrum ID | J2wDLzf3Nwe |
---|---|
Name | 2-Methyl[18O]cyclohexanone |
Comments | Less than 3 mono-isotopic peaks; Original formula: C7H12[18O] |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H12O |
InChI | InChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h6H,2-5H2,1H3/i8+2 |
InChIKey | LFSAPCRASZRSKS-PPJXEINESA-N |
Molecular Weight | 114.172 g/mol |
SMILES | C1(=[18O])C(C)CCCC1 |
SPLASH | splash10-02t9-9800000000-b2addd719e197e444611 |
Source of Spectrum | QF-8-4716-0 |
Wiley ID | 1558007 |