For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
L-(4R,5R)-4-{[(5-benzylaminocarbonyl-2,2-dimethyl-1,3-dioxolan-4-carboxyl)amino]-methyl}cyclohexyl methyl formate
SpectraBase Compound ID 82KOXy9xmNN
InChI InChI=1S/C23H32N2O6/c1-23(2)30-18(20(26)24-13-15-7-5-4-6-8-15)19(31-23)21(27)25-14-16-9-11-17(12-10-16)22(28)29-3/h4-8,16-19H,9-14H2,1-3H3,(H,24,26)(H,25,27)/t16?,17?,18-,19-/m1/s1
InChIKey WUZWHCBIYQVYLP-CSODTCANSA-N
Mol Weight 432.5 g/mol
Molecular Formula C23H32N2O6
Exact Mass 432.226037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3xvbFefed6Q
Name L-(4R,5R)-4-{[(5-benzylaminocarbonyl-2,2-dimethyl-1,3-dioxolan-4-carboxyl)amino]-methyl}cyclohexyl methyl formate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32N2O6
InChI InChI=1S/C23H32N2O6/c1-23(2)30-18(20(26)24-13-15-7-5-4-6-8-15)19(31-23)21(27)25-14-16-9-11-17(12-10-16)22(28)29-3/h4-8,16-19H,9-14H2,1-3H3,(H,24,26)(H,25,27)/t16?,17?,18-,19-/m1/s1
InChIKey WUZWHCBIYQVYLP-CSODTCANSA-N
Instrument Name Micromass ZabSpec
Ionization Type EI
Molecular Weight 432.517 g/mol
Optical Rotation [a]D20 = -34.3 (20mg/2ml, CH3OH)
SMILES N(CC1CCC(CC1)C(=O)OC)C([C@]1([C@](C(NCc2ccccc2)=O)(OC(O1)(C)C)[H])[H])=O
SPLASH splash10-002f-9700300000-94ba7bd279f20e13d6ee
Source of Spectrum CN101209976B
Wiley ID 1844536