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

*Links on SpectraBase are not permalinks.

Carbamic acid, [5-(1,2-dihydroxyethyl)-1,3,4,5-tetrahydrobenz[cd]indol-4-yl]methyl-, 1,1-dimethylethyl ester, [4.alpha.,5.alpha.(S*)]-(.+-.)-

View entire compound with spectra: 1 MS (GC)

Carbamic acid, [5-(1,2-dihydroxyethyl)-1,3,4,5-tetrahydrobenz[cd]indol-4-yl]methyl-, 1,1-dimethylethyl ester, [4.alpha.,5.alpha.(S*)]-(.+-.)-
SpectraBase Compound ID IZMMkGfwxSz
InChI InChI=1S/C19H26N2O4/c1-19(2,3)25-18(24)21(4)14-8-11-9-20-13-7-5-6-12(16(11)13)17(14)15(23)10-22/h5-7,9,14-15,17,20,22-23H,8,10H2,1-4H3/t14-,15+,17-/m0/s1
InChIKey WMNBSSNNUHTGMW-UXLLHSPISA-N
Mol Weight 346.43 g/mol
Molecular Formula C19H26N2O4
Exact Mass 346.189257 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 LgCyaspb7Oe
Name Carbamic acid, [5-(1,2-dihydroxyethyl)-1,3,4,5-tetrahydrobenz[cd]indol-4-yl]methyl-, 1,1-dimethylethyl ester, [4.alpha.,5.alpha.(S*)]-(.+-.)-
CAS Registry Number 76084-17-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26N2O4
InChI InChI=1S/C19H26N2O4/c1-19(2,3)25-18(24)21(4)14-8-11-9-20-13-7-5-6-12(16(11)13)17(14)15(23)10-22/h5-7,9,14-15,17,20,22-23H,8,10H2,1-4H3/t14-,15+,17-/m0/s1
InChIKey WMNBSSNNUHTGMW-UXLLHSPISA-N
Molecular Weight 346.427 g/mol
SMILES [nH]1c2cccc3c2c(C[C@@]([C@]3([C@@](CO)(O)[H])[H])(N(C(OC(C)(C)C)=O)C)[H])c1
SPLASH splash10-0zfr-1900000000-b51c67e4dac2a227d5f7
Source of Spectrum F-39-3702-0
Synonyms Benz[cd]indole, carbamic acid deriv. t-Butyl N-(4R*,5S*,1'S*)-5-(1',2'-dihydroxyethyl)-1,3,4,5-tetrahydrobenz(cd)indol-4-yl)N-methylcarbamate tert-Butyl (4S,5S)-5-[(1S)-1,2-dihydroxyethyl]-1,3,4,5-tetrahydrobenzo[cd]indol-4-yl(methyl)carbamate
Wiley ID 1339270