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Details

Stereochemistry RACEMIC
Molecular Formula C11H17N3
Molecular Weight 191.2728
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of trans-3?-aminomethylnicotine

SMILES

CN1CC[C@H](CN)[C@H]1C2=CC=CN=C2

InChI

InChIKey=IUMCSWXAFXSTAI-KOLCDFICSA-N
InChI=1S/C11H17N3/c1-14-6-4-9(7-12)11(14)10-3-2-5-13-8-10/h2-3,5,8-9,11H,4,6-7,12H2,1H3/t9-,11+/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H17N3
Molecular Weight 191.2728
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:01:00 GMT 2025
Edited
by admin
on Wed Apr 02 20:01:00 GMT 2025
Record UNII
NMC4AB837S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Pyrrolidinemethanamine, 1-methyl-2-(3-pyridinyl)-, (2R,3S)-rel-
Preferred Name English
trans-3?-aminomethylnicotine
Common Name English
Code System Code Type Description
PUBCHEM
16122816
Created by admin on Wed Apr 02 20:01:00 GMT 2025 , Edited by admin on Wed Apr 02 20:01:00 GMT 2025
PRIMARY
FDA UNII
NMC4AB837S
Created by admin on Wed Apr 02 20:01:00 GMT 2025 , Edited by admin on Wed Apr 02 20:01:00 GMT 2025
PRIMARY
CAS
623579-03-3
Created by admin on Wed Apr 02 20:01:00 GMT 2025 , Edited by admin on Wed Apr 02 20:01:00 GMT 2025
PRIMARY