SpectraBase Spectrum ID |
JneppmFziKJ |
Name |
Pyrrolidine, 2-(methoxymethyl)-1-[[1-methyl-2-(phenylmethylene)cyclohexyl]carbonyl]-, [S-[R*,R*-(E)]]- |
CAS Registry Number |
134389-50-7 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H29NO2 |
InChI |
InChI=1S/C21H29NO2/c1-21(20(23)22-14-8-12-19(22)16-24-2)13-7-6-11-18(21)15-17-9-4-3-5-10-17/h3-5,9-10,15,19H,6-8,11-14,16H2,1-2H3/b18-15+/t19-,21-/m0/s1 |
InChIKey |
XZGIKIRZSLPLAH-VNJZPOOUSA-N |
Molecular Weight |
327.468 g/mol |
SMILES |
C(N1[C@](COC)(CCC1)[H])([C@@]1(\C(=C\c2ccccc2)CCCC1)C)=O |
SPLASH |
splash10-004i-0009000000-cfff0183c6d70d9fd6d6 |
Source of Spectrum |
C-113-4936-15 |
Synonyms |
((2S)-1-{[(1S,2E)-2-benzylidene-1-methylcyclohexyl]carbonyl}pyrrolidinyl)methyl methyl ether
(1S,2S,2'S)-2-(benzylidene)-1-methyl-1-[[2'-(methoxymethyl)pyrrolinyl]carbonyl]cyclohexane
(2S)-1-{[(1S,2E)-2-benzylidene-1-methylcyclohexyl]carbonyl}-2-(methoxymethyl)pyrrolidine |
Wiley ID |
1325737 |