5-[2-(Benzylamino)-2-oxoethyl]-6-hydroxy-1-(hydroxymethyl)-1,4a-dimethyldecahydro-2-naphthalenyl isopropylcarbamate

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Systematic / IUPAC Name: [5-[2-(Benzylamino)-2-oxoethyl]-6-hydroxy-1-(hydroxymethyl)-1,4a-dimethyl-2,3,4,5,6,7,8,8a-octahydronaphthalen-2-yl] N-propan-2-ylcarbamate

ID: Reference9302

Other Names: Carbamic acid, N-(1-methylethyl)-, decahydro-6-hydroxy-1-(hydroxymethyl)-1,4a-dimethyl-5-[2-oxo-2-[(phenylmethyl)amino]ethyl]-2-naphthalenyl ester;
NAT8-282777

Formula: C26H40N2O5

Spectral Data

5-[2-(Benzylamino)-2-oxoethyl]-6-hydroxy-1-(hydroxymethyl)-1,4a-dimethyldecahydro-2-naphthalenyl isopropylcarbamate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 3972
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 1/24/2020 9:48:08 AM
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Identificators

InChI InChI=1S/C26H40N2O5/c1-17(2)28-24(32)33-22-12-13-25(3)19(20(30)10-11-21(25)26(22,4)16-29)14-23(31)27-15-18-8-6-5-7-9-18/h5-9,17,19-22,29-30H,10-16H2,1-4H3,(H,27,31)(H,28,32)
InChI Key MRQAMVHJQBOIKE-UHFFFAOYSA-N
Canonical SMILES CC(C)NC(=O)OC1CCC2(C(C1(C)CO)CCC(C2CC(=O)NCC3=CC=CC=C3)O)C
CAS
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Other Names Carbamic acid, N-(1-methylethyl)-, decahydro-6-hydroxy-1-(hydroxymethyl)-1,4a-dimethyl-5-[2-oxo-2-[(phenylmethyl)amino]ethyl]-2-naphthalenyl ester;
NAT8-282777

In Other Databases

PubChem 3608833
ChemSpider 2844326