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2-Propanol, 1-[[2,2-bis(1-methylethyl)-1,3-benzodioxol-5-yl]oxy]-3-[(1-methylethyl)amino]-
SpectraBase Compound ID 4ES6IMVb7h6
InChI InChI=1S/C19H31NO4/c1-12(2)19(13(3)4)23-17-8-7-16(9-18(17)24-19)22-11-15(21)10-20-14(5)6/h7-9,12-15,20-21H,10-11H2,1-6H3
InChIKey RKCAGFXVYNDJKN-UHFFFAOYSA-N
Mol Weight 337.46 g/mol
Molecular Formula C19H31NO4
Exact Mass 337.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LSmvIgOQBGP
Name 2-Propanol, 1-[[2,2-bis(1-methylethyl)-1,3-benzodioxol-5-yl]oxy]-3-[(1-methylethyl)amino]-
CAS Registry Number 94951-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H31NO4
InChI InChI=1S/C19H31NO4/c1-12(2)19(13(3)4)23-17-8-7-16(9-18(17)24-19)22-11-15(21)10-20-14(5)6/h7-9,12-15,20-21H,10-11H2,1-6H3
InChIKey RKCAGFXVYNDJKN-UHFFFAOYSA-N
Molecular Weight 337.460 g/mol
SMILES N(CC(COc1cc2OC(Oc2cc1)(C(C)C)C(C)C)O)C(C)C
SPLASH splash10-004i-1921000000-a7567db8706c196e6b42
Source of Spectrum O-19-497-2
Synonyms 1-[(2,2-diisopropyl-1,3-benzodioxol-5-yl)oxy]-3-(isopropylamino)-2-propanol 2,2-Diisopropyl-5-(2-hydroxy-3-isopropylaminopropoxy)-1,3-benzodioxole
Wiley ID 1333140