| SpectraBase Spectrum ID |
CQ9BoWiEwSL |
| Name |
3-[4-[[(2R)-2-amino-3-mercapto-propyl]amino]phenyl]benzoic acid methyl ester |
| Alternate Name(s) |
Methyl 3-[4-[[(2R)-2-amino-3-sulfanyl-propyl]amino]phenyl]benzoate
Methyl 3-[4-[[(2R)-2-azanyl-3-sulfanyl-propyl]amino]phenyl]benzoate
3-[4-[[(2R)-2-amino-3-mercaptopropyl]amino]phenyl]benzoic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H20N2O2S |
| InChI |
InChI=1S/C17H20N2O2S/c1-21-17(20)14-4-2-3-13(9-14)12-5-7-16(8-6-12)19-10-15(18)11-22/h2-9,15,19,22H,10-11,18H2,1H3/t15-/m1/s1 |
| InChIKey |
XJBBINSSZZHBDZ-OAHLLOKOSA-N |
| Molecular Weight |
316.419 g/mol |
| SMILES |
N(c1ccc(-c2cc(C(=O)OC)ccc2)cc1)C[C@](CS)(N)[H] |
| SPLASH |
splash10-0006-0091000000-6ca93f6e00ef1aedb558 |
| Source of Spectrum |
E1-39-223-9 |
| Wiley ID |
1598698 |
![3-[4-[[(2R)-2-amino-3-mercapto-propyl]amino]phenyl]benzoic acid methyl ester](/api/spectrum/CQ9BoWiEwSL/structure.png?h=300&w=458 "3-[4-[[(2R)-2-amino-3-mercapto-propyl]amino]phenyl]benzoic acid methyl ester")
