CID 22689422

878155-53-4

Structural Information

Molecular Formula
C7H16N2
SMILES
C[C@@H](CN1CCCC1)N
InChI
InChI=1S/C7H16N2/c1-7(8)6-9-4-2-3-5-9/h7H,2-6,8H2,1H3/t7-/m0/s1
InChIKey
ZLGZKMHJXLDWSP-ZETCQYMHSA-N
Compound name
(2S)-1-pyrrolidin-1-ylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

128.13135 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.13863 130.4
[M+Na]+ 151.12057 135.3
[M-H]- 127.12407 131.4
[M+NH4]+ 146.16517 152.1
[M+K]+ 167.09451 134.7
[M+H-H2O]+ 111.12861 123.9
[M+HCOO]- 173.12955 151.5
[M+CH3COO]- 187.14520 173.7
[M+Na-2H]- 149.10602 133.3
[M]+ 128.13080 125.4
[M]- 128.13190 125.4
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