| SpectraBase Spectrum ID |
5yRZl9smRrg |
| Name |
(3S,4S,5S,7aR)-(-)-3,5-Diphenyl-4-[(4-methoxyphenyl)methyl]pyrrolizidinium chloride |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H30ClNO |
| InChI |
InChI=1S/C27H30NO.ClH/c1-29-25-16-12-21(13-17-25)20-28-24(14-18-26(28)22-8-4-2-5-9-22)15-19-27(28)23-10-6-3-7-11-23;/h2-13,16-17,24,26-27H,14-15,18-20H2,1H3;1H/q+1;/p-1/t24?,26-,27-,28?;/m0./s1 |
| InChIKey |
UFEKRYHIXFKFKL-BLSYMFMPSA-M |
| Molecular Weight |
419.996 g/mol |
| SMILES |
[Cl-].[C@]1([N+]2(C(CC1)CC[C@]2(c1ccccc1)[H])Cc1ccc(OC)cc1)(c1ccccc1)[H] |
| SPLASH |
splash10-00di-0900000000-f3b1f01cad1ce4a26f5e |
| Source of Spectrum |
J-64-1731-6 |
| Synonyms |
(3S,5S)-4-[(4-methoxyphenyl)methyl]-3,5-diphenyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium;chloride |
| Wiley ID |
1529565 |
![(3S,4S,5S,7aR)-(-)-3,5-Diphenyl-4-[(4-methoxyphenyl)methyl]pyrrolizidinium chloride](/api/spectrum/5yRZl9smRrg/structure.png?h=300&w=458 "(3S,4S,5S,7aR)-(-)-3,5-Diphenyl-4-[(4-methoxyphenyl)methyl]pyrrolizidinium chloride")
