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(1S, 2R, 3S, 6R)-6-Acetylamino-1,2-O-isopropylidene-3-cyclohexylcyclohex-4-ene, 1,2,3-triol
SpectraBase Compound ID GBTOIM6xAk2
InChI InChI=1S/C17H27NO4/c1-11(19)18-13-9-10-17(20,12-7-5-4-6-8-12)15-14(13)21-16(2,3)22-15/h9-10,12-15,20H,4-8H2,1-3H3,(H,18,19)/t13-,14+,15-,17-/m1/s1
InChIKey JMNVUYKVSNZVQQ-JYYAWHABSA-N
Mol Weight 309.41 g/mol
Molecular Formula C17H27NO4
Exact Mass 309.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1G5ruhsAng
Name (1S, 2R, 3S, 6R)-6-Acetylamino-1,2-O-isopropylidene-3-cyclohexylcyclohex-4-ene, 1,2,3-triol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H27NO4
InChI InChI=1S/C17H27NO4/c1-11(19)18-13-9-10-17(20,12-7-5-4-6-8-12)15-14(13)21-16(2,3)22-15/h9-10,12-15,20H,4-8H2,1-3H3,(H,18,19)/t13-,14+,15-,17-/m1/s1
InChIKey JMNVUYKVSNZVQQ-JYYAWHABSA-N
Molecular Weight 309.406 g/mol
SMILES N([C@]1([C@]2([C@]([C@@](C=C1)(C1CCCCC1)O)(OC(O2)(C)C)[H])[H])[H])C(=O)C
SPLASH splash10-0a5c-9340000000-0cdbe8d78727350ac785
Source of Spectrum F-66-3766-37
Wiley ID 1685412