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Oxacyclotridecane, phosphonic acid deriv.
SpectraBase Compound ID 2wlG0s8jBhJ
InChI InChI=1S/C16H31O5P/c1-3-20-22(18,21-4-2)15-13-11-9-7-5-6-8-10-12-14-19-16(15)17/h15H,3-14H2,1-2H3
InChIKey NVDZSNGSDCCFQV-UHFFFAOYSA-N
Mol Weight 334.39 g/mol
Molecular Formula C16H31O5P
Exact Mass 334.190911 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4r2lykj1deb
Name Oxacyclotridecane, phosphonic acid deriv.
Alternate Name(s) Phosphonic acid, (2-oxooxacyclotridec-3-yl)-, diethyl ester .alpha.-(diethoxyphosphinyl)-1-oxacyclotridecan-2-one Diethyl 2-oxooxacyclotridecan-3-ylphosphonate
CAS Registry Number 122593-71-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H31O5P
InChI InChI=1S/C16H31O5P/c1-3-20-22(18,21-4-2)15-13-11-9-7-5-6-8-10-12-14-19-16(15)17/h15H,3-14H2,1-2H3
InChIKey NVDZSNGSDCCFQV-UHFFFAOYSA-N
Molecular Weight 334.393 g/mol
SMILES C1(P(=O)(OCC)OCC)C(OCCCCCCCCCC1)=O
SPLASH splash10-0a4i-7900000000-46bf00e65610a5c82ef9
Source of Spectrum J-54-4753-17
Wiley ID 1330766