(1S,2S,3R,4R,6S)-4-(Acetoxymethyl)-6-[4-(4-methylphenyl)-1H-1,2,3-triazol-1-yl]cyclohexane-1,2,3-triyl Triacetate

SpectraBase Compound ID	AdF7xkNIwzf
InChI	InChI=1S/C24H29N3O8/c1-13-6-8-18(9-7-13)20-11-27(26-25-20)21-10-19(12-32-14(2)28)22(33-15(3)29)24(35-17(5)31)23(21)34-16(4)30/h6-9,11,19,21-24H,10,12H2,1-5H3/t19-,21+,22-,23+,24+/m1/s1
InChIKey	OQXXGSPRYALXDE-NZURDFQBSA-N Google Search
Mol Weight	487.51 g/mol
Molecular Formula	C24H29N3O8
Exact Mass	487.195465 g/mol

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SpectraBase Spectrum ID	fhXpAIETLt
Name	(1S,2S,3R,4R,6S)-4-(Acetoxymethyl)-6-[4-(4-methylphenyl)-1H-1,2,3-triazol-1-yl]cyclohexane-1,2,3-triyl Triacetate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H29N3O8
InChI	InChI=1S/C24H29N3O8/c1-13-6-8-18(9-7-13)20-11-27(26-25-20)21-10-19(12-32-14(2)28)22(33-15(3)29)24(35-17(5)31)23(21)34-16(4)30/h6-9,11,19,21-24H,10,12H2,1-5H3/t19-,21+,22-,23+,24+/m1/s1
InChIKey	OQXXGSPRYALXDE-NZURDFQBSA-N
Molecular Weight	487.509 g/mol
SMILES	c1(nn[n](c1)[C@@]1([C@@]([C@@](OC(=O)C)([C@@]([C@](C1)(COC(=O)C)[H])(OC(=O)C)[H])[H])(OC(=O)C)[H])[H])-c1ccc(cc1)C
SPLASH	splash10-00m3-2920200000-89bb3274d871a342625f
Source of Spectrum	U1-2014-3629-13b
Synonyms	(1S,2S,3R,4R,6S)-4-(acetoxymethyl)-6-(4-(p-tolyl)-1H-1,2,3-triazol-1-yl)cyclohexane-1,2,3-triyl triacetate
Wiley ID	1740716