CID 131045249

Rac-[(3r,4r)-4-propylpyrrolidin-3-yl]methanol

Structural Information

Molecular Formula
C8H17NO
SMILES
CCC[C@@H]1CNC[C@H]1CO
InChI
InChI=1S/C8H17NO/c1-2-3-7-4-9-5-8(7)6-10/h7-10H,2-6H2,1H3/t7-,8+/m1/s1
InChIKey
POKJDNZQLCRMFC-SFYZADRCSA-N
Compound name
[(3S,4S)-4-propylpyrrolidin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 134.5
[M+Na]+ 166.12023 140.2
[M-H]- 142.12373 133.3
[M+NH4]+ 161.16483 155.1
[M+K]+ 182.09417 137.8
[M+H-H2O]+ 126.12827 128.8
[M+HCOO]- 188.12921 153.0
[M+CH3COO]- 202.14486 169.6
[M+Na-2H]- 164.10568 137.0
[M]+ 143.13046 130.3
[M]- 143.13156 130.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.