CID 44230919

(2s)-2-(pyrrolidin-1-yl)butanamide

Structural Information

Molecular Formula
C8H16N2O
SMILES
CC[C@@H](C(=O)N)N1CCCC1
InChI
InChI=1S/C8H16N2O/c1-2-7(8(9)11)10-5-3-4-6-10/h7H,2-6H2,1H3,(H2,9,11)/t7-/m0/s1
InChIKey
DQOSEHWNUDEBQL-ZETCQYMHSA-N
Compound name
(2S)-2-pyrrolidin-1-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

156.12627 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.13355 137.4
[M+Na]+ 179.11549 141.8
[M-H]- 155.11899 138.3
[M+NH4]+ 174.16009 157.8
[M+K]+ 195.08943 141.3
[M+H-H2O]+ 139.12353 130.7
[M+HCOO]- 201.12447 157.5
[M+CH3COO]- 215.14012 178.7
[M+Na-2H]- 177.10094 138.5
[M]+ 156.12572 132.8
[M]- 156.12682 132.8
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

patents stripe