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1-Methyldodecyl phenylacetate
SpectraBase Compound ID HyScousHIpF
InChI InChI=1S/C21H34O2/c1-3-4-5-6-7-8-9-10-12-15-19(2)23-21(22)18-20-16-13-11-14-17-20/h11,13-14,16-17,19H,3-10,12,15,18H2,1-2H3
InChIKey JYWWMBSSJAQJCU-UHFFFAOYSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2zQPXppcI2i
Name 1-Methyldodecyl phenylacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-3-4-5-6-7-8-9-10-12-15-19(2)23-21(22)18-20-16-13-11-14-17-20/h11,13-14,16-17,19H,3-10,12,15,18H2,1-2H3
InChIKey JYWWMBSSJAQJCU-UHFFFAOYSA-N
Molecular Weight 318.501 g/mol
SMILES c1cc(CC(OC(C)CCCCCCCCCCC)=O)ccc1
SPLASH splash10-052f-9000000000-13d25d62938c90ce5a9a
Source of Spectrum NP-11-1394-0
Synonyms Benzeneacetic acid, 2-tridecyl ester 2-Phenylacetic acid tridecan-2-yl ester Tridecan-2-yl 2-phenylacetate 1-Methyldodecyl 2-phenylacetate Tridecan-2-yl 2-phenylethanoate
Wiley ID 1109413