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N1-[2'-Hydroxy-3'-(2"-nitroimidazol-1"-yl)propyl]-N1,N4-methylene-N8-(tert-Butoxycarbonyl)spermidine
SpectraBase Compound ID KODGzIlBoaH
InChI InChI=1S/C19H33N6O5/c1-19(2,3)30-18(27)21-7-4-5-9-22-10-6-11-23(15-22)13-16(26)14-24-12-8-20-17(24)25(28)29/h8-9,12,16,26H,4-7,10-11,13-15H2,1-3H3,(H,21,27)/b22-9+
InChIKey ZFUIIMGAFPTTGQ-LSFURLLWSA-N
Mol Weight 425.5 g/mol
Molecular Formula C19H33N6O5
Exact Mass 425.251243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DIFIxXFSelK
Name N1-[2'-Hydroxy-3'-(2"-nitroimidazol-1"-yl)propyl]-N1,N4-methylene-N8-(tert-Butoxycarbonyl)spermidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H33N6O5
InChI InChI=1S/C19H33N6O5/c1-19(2,3)30-18(27)21-7-4-5-9-22-10-6-11-23(15-22)13-16(26)14-24-12-8-20-17(24)25(28)29/h8-9,12,16,26H,4-7,10-11,13-15H2,1-3H3,(H,21,27)/b22-9+
InChIKey ZFUIIMGAFPTTGQ-LSFURLLWSA-N
Molecular Weight 425.510 g/mol
SMILES N(C(OC(C)(C)C)=O)CCCC=[N]1CN(CC(C[n]2c(N(=O)=O)ncc2)O)CCC1
SPLASH splash10-0zfr-9100100000-f00b22a9b9932c916aa6
Source of Spectrum KC-0-3248-15
Synonyms N1-[2'-Hydroxy-3'-(2''-nitro-imidazol-1''-yl)-propyl]-N1,N4-methylene-N8-(tert-Butoxycarbonyl)-spermidine
Wiley ID 829470