| SpectraBase Spectrum ID |
2ntECEubrEm |
| Name |
Hexanoic acid anhydride |
| CAS Registry Number |
2051-49-2 |
| Classification |
Acylating agent |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
214.156894565 u |
| Formula |
C12H22O3 |
| InChI |
InChI=1S/C12H22O3/c1-3-5-7-9-11(13)15-12(14)10-8-6-4-2/h3-10H2,1-2H3 |
| InChIKey |
PKHMTIRCAFTBDS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
214.305 g/mol |
| Nominal Mass |
214 u |
| Quality |
995 |
| Retention Index |
1490 |
| SMILES |
C(OC(CCCCC)=O)(CCCCC)=O |
| SPLASH |
splash10-0005-9000000000-13a7321d2838845a2c5c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Caproic anhydrid
hexanoic anhydride |
| Technique |
GC/MS |
| Wiley ID |
DD2024_010267 |
