CID 53256083

(r)-(3-aminopyrrolidin-1-yl)(cyclopropyl)methanone hydrochloride

Structural Information

Molecular Formula
C8H14N2O
SMILES
C1CN(C[C@@H]1N)C(=O)C2CC2
InChI
InChI=1S/C8H14N2O/c9-7-3-4-10(5-7)8(11)6-1-2-6/h6-7H,1-5,9H2/t7-/m1/s1
InChIKey
QTYGXDUXIZLHGI-SSDOTTSWSA-N
Compound name
[(3R)-3-aminopyrrolidin-1-yl]-cyclopropylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

154.11061 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.11789 134.0
[M+Na]+ 177.09983 141.9
[M-H]- 153.10333 139.5
[M+NH4]+ 172.14443 150.0
[M+K]+ 193.07377 139.1
[M+H-H2O]+ 137.10787 127.3
[M+HCOO]- 199.10881 155.5
[M+CH3COO]- 213.12446 180.3
[M+Na-2H]- 175.08528 136.4
[M]+ 154.11006 131.9
[M]- 154.11116 131.9
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