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2-Butoxy-3-butyl-heptane-1,2,3-tricarboxylic acid

View entire compound with spectra: 1 MS (GC)

2-Butoxy-3-butyl-heptane-1,2,3-tricarboxylic acid
SpectraBase Compound ID 8niBACeduIT
InChI InChI=1S/C18H32O7/c1-4-7-10-17(15(21)22,11-8-5-2)18(16(23)24,13-14(19)20)25-12-9-6-3/h4-13H2,1-3H3,(H,19,20)(H,21,22)(H,23,24)
InChIKey SSLHAUKBKSPHRE-UHFFFAOYSA-N
Mol Weight 360.4 g/mol
Molecular Formula C18H32O7
Exact Mass 360.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24SWKH04F78
Name 2-Butoxy-3-butyl-heptane-1,2,3-tricarboxylic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H32O7
InChI InChI=1S/C18H32O7/c1-4-7-10-17(15(21)22,11-8-5-2)18(16(23)24,13-14(19)20)25-12-9-6-3/h4-13H2,1-3H3,(H,19,20)(H,21,22)(H,23,24)
InChIKey SSLHAUKBKSPHRE-UHFFFAOYSA-N
Molecular Weight 360.447 g/mol
SMILES OC(C(C(C(=O)O)(CC(=O)O)OCCCC)(CCCC)CCCC)=O
SPLASH splash10-0570-8920000000-3ffe169d29960e3124d9
Source of Spectrum IC-1027-0-0
Wiley ID 1348225