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(phenylmethyl) N-[1-[1-[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]ethylamino]-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate
SpectraBase Compound ID 4EoXS5NPa1Z
InChI InChI=1S/C21H31N7O3/c1-6-13(2)16(24-21(30)31-12-15-10-8-7-9-11-15)18(29)23-14(3)17-25-19(22)27-20(26-17)28(4)5/h7-11,13-14,16H,6,12H2,1-5H3,(H,23,29)(H,24,30)(H2,22,25,26,27)
InChIKey IAGRXASQIBWSGB-UHFFFAOYSA-N
Mol Weight 429.53 g/mol
Molecular Formula C21H31N7O3
Exact Mass 429.248838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 70vmtb3dWrN
Name (phenylmethyl) N-[1-[1-[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]ethylamino]-3-methyl-1-oxidanylidene-pentan-2-yl]carbamate
CAS Registry Number 60603-75-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31N7O3
InChI InChI=1S/C21H31N7O3/c1-6-13(2)16(24-21(30)31-12-15-10-8-7-9-11-15)18(29)23-14(3)17-25-19(22)27-20(26-17)28(4)5/h7-11,13-14,16H,6,12H2,1-5H3,(H,23,29)(H,24,30)(H2,22,25,26,27)
InChIKey IAGRXASQIBWSGB-UHFFFAOYSA-N
Molecular Weight 429.525 g/mol
SMILES N(C(C(NC(=O)OCc1ccccc1)C(CC)C)=O)C(c1nc(nc(n1)N(C)C)N)C
SPLASH splash10-066u-9750000000-5fe79381d61dac473b9f
Source of Spectrum C-13-6-6
Synonyms 2-(1-(2-Benzoxycarbonylamino-3-methylpentanamido)ethyl)-4-amino-6-dimethylamino-s-triazine benzyl N-[1-[1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethylamino]-3-methyl-1-oxopentan-2-yl]carbamate benzyl N-[1-[1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethylcarbamoyl]-2-methyl-butyl]carbamate N-[1-[1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethylamino]-3-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester N-[1-[1-[4-amino-6-(dimethylamino)-s-triazin-2-yl]ethylcarbamoyl]-2-methyl-butyl]carbamic acid benzyl ester
Wiley ID 1381137