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N-Acryloyl-2.alpha.-[2-trans-(4'-methoxyphenyl)ethenyl]-4,4,7-trimethyl-trans-octahydro-1,3-benzoxazine
SpectraBase Compound ID KhetzGg7pTh
InChI InChI=1S/C23H31NO3/c1-6-21(25)24-22(14-10-17-8-11-18(26-5)12-9-17)27-20-15-16(2)7-13-19(20)23(24,3)4/h6,8-12,14,16,19-20,22H,1,7,13,15H2,2-5H3/b14-10+/t16?,19-,20-,22-/m1/s1
InChIKey OOUJUZCQSKBFKV-LRWALKGWSA-N
Mol Weight 369.51 g/mol
Molecular Formula C23H31NO3
Exact Mass 369.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUWEDttVgpk
Name N-Acryloyl-2.alpha.-[2-trans-(4'-methoxyphenyl)ethenyl]-4,4,7-trimethyl-trans-octahydro-1,3-benzoxazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H31NO3
InChI InChI=1S/C23H31NO3/c1-6-21(25)24-22(14-10-17-8-11-18(26-5)12-9-17)27-20-15-16(2)7-13-19(20)23(24,3)4/h6,8-12,14,16,19-20,22H,1,7,13,15H2,2-5H3/b14-10+/t16?,19-,20-,22-/m1/s1
InChIKey OOUJUZCQSKBFKV-LRWALKGWSA-N
Molecular Weight 369.505 g/mol
SMILES C1(N([C@](O[C@@]2(CC(CC[C@@]12[H])C)[H])(\C=C\c1ccc(cc1)OC)[H])C(C=C)=O)(C)C
SPLASH splash10-0a59-9100000000-81d7481e0068d0adbf2b
Source of Spectrum J-67-785-2
Synonyms (2R,4aS,8aR)-3-acryloyl-2-[(E)-2-(4-methoxyphenyl)ethenyl]-4,4,7-trimethyloctahydro-2H-1,3-benzoxazine 4-{(E)-2-[(2R,4aS,8aR)-3-acryloyl-4,4,7-trimethyloctahydro-2H-1,3-benzoxazin-2-yl]ethenyl}phenyl methyl ether
Wiley ID 1569097