SpectraBase Compound ID | KYJp23v2VkI |
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InChI | InChI=1S/C7H14O2/c1-3-4-5-6-9-7(2)8/h3-6H2,1-2H3/i4D2 |
InChIKey | PGMYKACGEOXYJE-APZFVMQVSA-N |
Mol Weight | 132.2 g/mol |
Molecular Formula | C7H12D2O2 |
Exact Mass | 132.111933 g/mol |
SpectraBase Spectrum ID | KGcr2qzJdSb |
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Name | 1-Pentyl-3,3-D2 acetate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H12D2O2 |
InChI | InChI=1S/C7H14O2/c1-3-4-5-6-9-7(2)8/h3-6H2,1-2H3/i4D2 |
InChIKey | PGMYKACGEOXYJE-APZFVMQVSA-N |
Molecular Weight | 132.199 g/mol |
SMILES | C(=O)(OCCC(CC)([D])[D])C |
SPLASH | splash10-006x-9000000000-392cc01046caa60bd4db |
Source of Spectrum | C-86-2377-1 |
Wiley ID | 1132799 |