CID 69319994

5,6-dihydro-4h-pyrrolo[1,2-b]pyrazole-3-carboxylic acid

Structural Information

Molecular Formula
C7H8N2O2
SMILES
C1CC2=C(C=NN2C1)C(=O)O
InChI
InChI=1S/C7H8N2O2/c10-7(11)5-4-8-9-3-1-2-6(5)9/h4H,1-3H2,(H,10,11)
InChIKey
CCRGDNIETIHGAG-UHFFFAOYSA-N
Compound name
5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

74
Patents

152.05858 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.06586 130.4
[M+Na]+ 175.04780 139.8
[M+NH4]+ 170.09240 138.0
[M+K]+ 191.02174 139.4
[M-H]- 151.05130 129.4
[M+Na-2H]- 173.03325 133.4
[M]+ 152.05803 131.0
[M]- 152.05913 131.0
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

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