SpectraBase Compound ID | G3nizncRgZJ |
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InChI | InChI=1S/C7H14O2/c1-6(2)4-5-7(8)9-3/h6H,4-5H2,1-3H3/i6D |
InChIKey | KBCOVKHULBZKNY-RAMDWTOOSA-N |
Mol Weight | 131.19 g/mol |
Molecular Formula | C7H13DO2 |
Exact Mass | 131.105656 g/mol |
SpectraBase Spectrum ID | 5HCs4ZXQV9A |
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Name | Methyl 4-methylpentanoate-4-D1 |
CAS Registry Number | 29366-30-1 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H13DO2 |
InChI | InChI=1S/C7H14O2/c1-6(2)4-5-7(8)9-3/h6H,4-5H2,1-3H3/i6D |
InChIKey | KBCOVKHULBZKNY-RAMDWTOOSA-N |
Molecular Weight | 131.193 g/mol |
SMILES | C(=O)(CCC(C)(C)[D])OC |
SPLASH | splash10-0553-9000000000-0931d92ce4ba6d881eb2 |
Source of Spectrum | C-92-3086-4 |
Wiley ID | 5689 |