| SpectraBase Spectrum ID |
HPmSNWn61bO |
| Name |
1-Butanol, 3-methyl-, benzoate |
| CAS Registry Number |
94-46-2 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey |
MLLAPOCBLWUFAP-UHFFFAOYSA-N |
| Molecular Weight |
192.258 g/mol |
| SMILES |
c1ccc(cc1)C(=O)OCCC(C)C |
| SPLASH |
splash10-05fr-9300000000-5869f9f49d0da7047875 |
| Source of Spectrum |
LQ-1992-952-0 |
| Synonyms |
1-(3-Methyl)butyl benzoate
3-Methylbutyl benzoate
3-Methyl-1-butyl benzoate
Isopentyl alcohol, benzoate
benzoic acid 3-methylbutyl ester
Benzoic acid isoamyl ester
Benzoic acid, 1-(3-methyl)butyl ester
Benzoic acid, isopentyl ester
Isoamyl benzoate
Isopentyl benzoate
AI3-01966
BRN 1946447
EINECS 202-334-4
FEMA NO. 2058
NSC 9284 |
| Wiley ID |
1188669 |
