SpectraBase Spectrum ID |
6km6UGYSQja |
Name |
HEPTANOIC ACID, 3-METHYLBUTYL ESTER |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Exact Mass |
200.177630011 u |
Formula |
C12H24O2 |
InChI |
InChI=1S/C12H24O2/c1-4-5-6-7-8-12(13)14-10-9-11(2)3/h11H,4-10H2,1-3H3 |
InChIKey |
AFCXVDRTNQNGHS-UHFFFAOYSA-N |
Molecular Weight |
200.322 g/mol |
Nominal Mass |
200 u |
Number of Peaks |
59 |
SMILES |
C(CCCC(OCCC(C)C)=O)CC |
SPLASH |
splash10-00dl-9100000000-1063f9bb500ab8a9e6b7 |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
Wiley ID |
MVX_001421 |