Chemical identity

(S)-N-Nitroso Anabasine

CAS 1133-64-8 · C10H13N3O

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-00879
PubChem CID7069270
Name(S)-N-Nitroso Anabasine
CAS RN1133-64-8
Molecular formulaC10H13N3O
Molecular weight191.23 g/mol
IUPAC name3-[(2S)-1-Nitroso-2-piperidinyl]pyridine
InChIKeyBXYPVKMROLGXJI-JTQLQIEISA-N

02Structure identifiers

2D structurePubChem CID 7069270
Two-dimensional chemical structure of (S)-N-Nitroso Anabasine, CAS 1133-64-8
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre, contains an N-nitroso substructure. These statements are calculated from the published structure string.

Defined stereocentres1
Unassigned stereocentres0
Ring count2
Secondary amines0
Tertiary amines1
N-methyl amine sites0
SMILESC1CCN([C@@H](C1)C2=CN=CC=C2)N=O
InChINot listed
Formula from structureC10H13N3O
Molecular weight from structure191.23 g/mol

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

2 records

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNO EXACT MATCH FOUNDCAS 1133-64-8 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 1133-64-8 has no exact match in the reviewed SCOMET list.
Review date2026-08-01Recheck the current official instruments for the material, concentration, activity and date in question.

05Names and relationships

Associated parent compound

Nicotine

View API and impurity family

Other names

  • N-Nitrosoanabasine
  • 1133-64-8
  • 3-[(2S)-1-nitrosopiperidin-2-yl]pyridine
  • 1-Nitrosoanabasine
  • (R,s)-n-nitrosoanabasine
  • Anabasine, 1-nitroso-
  • (S)-3-(1-Nitroso-2-piperidinyl)pyridine
  • (S)-3-(1-Nitrosopiperidin-2-yl)pyridine
  • Pyridine, 3-(1-nitroso-2-piperidinyl)-, (S)-
  • 37X858NS29
  • (S)-N-Nitroso Anabasine (1.0 mg/ml in Acetonitrile)
  • (S)-N-Nitroso Anabasine

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources