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

*Links on SpectraBase are not permalinks.
rac-(3aR,5R,7S,7aR)-5-(2,3-dimethylphenyl)-1,3,3,5,7-pentamethyloctahydrobenzo[c]Isoxazole
SpectraBase Compound ID Jp2eLX0BO1u
InChI InChI=1S/C20H31NO/c1-13-9-8-10-16(15(13)3)20(6)11-14(2)18-17(12-20)19(4,5)22-21(18)7/h8-10,14,17-18H,11-12H2,1-7H3/t14-,17+,18+,20+/m0/s1
InChIKey JPFAEJTYZIRZBQ-LMVHDODDSA-N
Mol Weight 301.47 g/mol
Molecular Formula C20H31NO
Exact Mass 301.240565 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 2zNpwQt14S
Name rac-(3aR,5R,7S,7aR)-5-(2,3-dimethylphenyl)-1,3,3,5,7-pentamethyloctahydrobenzo[c]Isoxazole
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31NO
InChI InChI=1S/C20H31NO/c1-13-9-8-10-16(15(13)3)20(6)11-14(2)18-17(12-20)19(4,5)22-21(18)7/h8-10,14,17-18H,11-12H2,1-7H3/t14-,17+,18+,20+/m0/s1
InChIKey JPFAEJTYZIRZBQ-LMVHDODDSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 301.474 g/mol
SMILES [C@@]1(C[C@@]2([C@](N(OC2(C)C)C)([C@](C1)(C)[H])[H])[H])(C)c1cccc(c1C)C
SPLASH splash10-0ufr-4903000000-69b9bb53448ad759264f
Source of Spectrum CN114761385A
Wiley ID 1884399