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O-acetyl-nitraraine
SpectraBase Compound ID 9O9zy2g7Cif
InChI InChI=1S/C22H26N2O2/c1-14(25)26-13-16-6-4-5-15-12-24-10-9-18-17-7-2-3-8-20(17)23-22(18)21(24)11-19(15)16/h2-3,6-8,15,19,21,23H,4-5,9-13H2,1H3
InChIKey MQSBUCVBSSNACN-UHFFFAOYSA-N
Mol Weight 350.46 g/mol
Molecular Formula C22H26N2O2
Exact Mass 350.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2SjhSbRG2C
Name O-acetyl-nitraraine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O2
InChI InChI=1S/C22H26N2O2/c1-14(25)26-13-16-6-4-5-15-12-24-10-9-18-17-7-2-3-8-20(17)23-22(18)21(24)11-19(15)16/h2-3,6-8,15,19,21,23H,4-5,9-13H2,1H3
InChIKey MQSBUCVBSSNACN-UHFFFAOYSA-N
Molecular Weight 350.462 g/mol
SMILES [nH]1c2ccccc2c2c1C1N(CC2)CC2CCC=C(C2C1)COC(=O)C
SPLASH splash10-0udl-0049000000-bdc24a0cee905556a0cc
Source of Spectrum X4-21-505-0
Synonyms 16,17-didehydroyohimban-16-ylmethyl acetate 16-[(Acetoxy)methyl]-yohimbine
Wiley ID 1585904