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2H-1-Benzopyran-3-ol, 8-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-3,4-dihydro-, 3-nitrate
SpectraBase Compound ID xhv6TFJWoZ
InChI InChI=1S/C16H24N2O6/c1-16(2,3)17-8-12(19)9-22-14-6-4-5-11-7-13(24-18(20)21)10-23-15(11)14/h4-6,12-13,17,19H,7-10H2,1-3H3
InChIKey GOPCFCXTHDGOIW-UHFFFAOYSA-N
Mol Weight 340.38 g/mol
Molecular Formula C16H24N2O6
Exact Mass 340.163436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YN5KZM7Rn7
Name 2H-1-Benzopyran-3-ol, 8-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-3,4-dihydro-, 3-nitrate
CAS Registry Number 81486-87-5
Comments Removed - unrepairable contamination (CH2Cl2)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24N2O6
InChI InChI=1S/C16H24N2O6/c1-16(2,3)17-8-12(19)9-22-14-6-4-5-11-7-13(24-18(20)21)10-23-15(11)14/h4-6,12-13,17,19H,7-10H2,1-3H3
InChIKey GOPCFCXTHDGOIW-UHFFFAOYSA-N
Molecular Weight 340.376 g/mol
SMILES N(CC(COc1c2OCC(ON(=O)=O)Cc2ccc1)O)C(C)(C)C
SPLASH splash10-000i-9000000000-ef137365269bf32633d5
Source of Spectrum O-25-148-5
Synonyms 3,4-Dihydro-8-[2-hydroxy-3-(t-butyl)amino]propoxy-3-nitrooxy-2H-1-benzopyran 8-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-2H-chromen-3-yl nitrate
Wiley ID 1334949