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Details

Stereochemistry MIXED
Molecular Formula C11H17N3O2
Molecular Weight 223.2716
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(ALPHA-(NITROETHYL)BENZYL) ETHYLENEDIAMINE

SMILES

CC(C(NCCN)C1=CC=CC=C1)[N+]([O-])=O

InChI

InChIKey=KHUHJMXIOOBDQH-UHFFFAOYSA-N
InChI=1S/C11H17N3O2/c1-9(14(15)16)11(13-8-7-12)10-5-3-2-4-6-10/h2-6,9,11,13H,7-8,12H2,1H3

HIDE SMILES / InChI

Molecular Formula C11H17N3O2
Molecular Weight 223.2716
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
0206WBH0YU
Record Status Validated (UNII)
Record Version