CID 45116029

73462-80-3

Structural Information

Molecular Formula
C8H14N2O2
SMILES
CC(=O)N1CCC[C@@H]1C(=O)NC
InChI
InChI=1S/C8H14N2O2/c1-6(11)10-5-3-4-7(10)8(12)9-2/h7H,3-5H2,1-2H3,(H,9,12)/t7-/m1/s1
InChIKey
DPDXFAYSYVRXMF-SSDOTTSWSA-N
Compound name
(2R)-1-acetyl-N-methylpyrrolidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

170.10553 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.11281 138.4
[M+Na]+ 193.09475 144.2
[M-H]- 169.09825 140.4
[M+NH4]+ 188.13935 158.8
[M+K]+ 209.06869 143.9
[M+H-H2O]+ 153.10279 132.1
[M+HCOO]- 215.10373 159.6
[M+CH3COO]- 229.11938 180.4
[M+Na-2H]- 191.08020 140.0
[M]+ 170.10498 135.8
[M]- 170.10608 135.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe