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1-(2,5,5-trimethyl-1,3-dioxan-2-yl)-4-heptanamine

View entire compound with spectra: 1 MS (GC)

1-(2,5,5-trimethyl-1,3-dioxan-2-yl)-4-heptanamine
SpectraBase Compound ID 70cJ9a4WAKV
InChI InChI=1S/C14H29NO2/c1-5-7-12(15)8-6-9-14(4)16-10-13(2,3)11-17-14/h12H,5-11,15H2,1-4H3
InChIKey NORBLYDQSRCABM-UHFFFAOYSA-N
Mol Weight 243.39 g/mol
Molecular Formula C14H29NO2
Exact Mass 243.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B22jsC5SC3c
Name 1-(2,5,5-trimethyl-1,3-dioxan-2-yl)-4-heptanamine
CAS Registry Number 109531-98-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H29NO2
InChI InChI=1S/C14H29NO2/c1-5-7-12(15)8-6-9-14(4)16-10-13(2,3)11-17-14/h12H,5-11,15H2,1-4H3
InChIKey NORBLYDQSRCABM-UHFFFAOYSA-N
Molecular Weight 243.391 g/mol
SMILES NC(CCCC1(OCC(CO1)(C)C)C)CCC
SPLASH splash10-00ba-9530000000-cebcf11f3391434b1205
Source of Spectrum J-52-4277-4
Synonyms 1-(2,5,5-trimethyl-1,3-dioxan-2-yl)heptan-4-amine
Wiley ID 1246126