CID 126154

Cyclo(prolylglycyl)

Structural Information

Molecular Formula
C7H10N2O2
SMILES
C1C[C@H]2C(=O)NCC(=O)N2C1
InChI
InChI=1S/C7H10N2O2/c10-6-4-8-7(11)5-2-1-3-9(5)6/h5H,1-4H2,(H,8,11)/t5-/m0/s1
InChIKey
OWOHLURDBZHNGG-YFKPBYRVSA-N
Compound name
(8aS)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

48
References

1132
Patents

154.07423 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.08151 131.8
[M+Na]+ 177.06345 139.2
[M-H]- 153.06695 131.7
[M+NH4]+ 172.10805 152.2
[M+K]+ 193.03739 136.7
[M+H-H2O]+ 137.07149 125.5
[M+HCOO]- 199.07243 148.4
[M+CH3COO]- 213.08808 171.6
[M+Na-2H]- 175.04890 135.6
[M]+ 154.07368 126.1
[M]- 154.07478 126.1
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