CID 124509986

Rac-(3ar,6as)-octahydrocyclopenta[b]pyrrole-3a-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1C[C@@H]2[C@](C1)(CCN2)C(=O)O
InChI
InChI=1S/C8H13NO2/c10-7(11)8-3-1-2-6(8)9-5-4-8/h6,9H,1-5H2,(H,10,11)/t6-,8+/m1/s1
InChIKey
OUQOATBOHJQCRJ-SVRRBLITSA-N
Compound name
(3aS,6aR)-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[b]pyrrole-3a-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

-2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 135.3
[M+Na]+ 178.08386 142.1
[M+NH4]+ 173.12846 144.5
[M+K]+ 194.05780 139.8
[M-H]- 154.08736 134.0
[M+Na-2H]- 176.06931 137.7
[M]+ 155.09409 135.5
[M]- 155.09519 135.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.