CID 132472416

2639417-72-2

Structural Information

Molecular Formula
C9H12N2O3
SMILES
C1CC1COC2=CN(N=C2)CC(=O)O
InChI
InChI=1S/C9H12N2O3/c12-9(13)5-11-4-8(3-10-11)14-6-7-1-2-7/h3-4,7H,1-2,5-6H2,(H,12,13)
InChIKey
IOTFLLMPPFLQMP-UHFFFAOYSA-N
Compound name
2-[4-(cyclopropylmethoxy)pyrazol-1-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.0848 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.09208 145.4
[M+Na]+ 219.07402 156.7
[M+NH4]+ 214.11862 152.2
[M+K]+ 235.04796 155.3
[M-H]- 195.07752 152.0
[M+Na-2H]- 217.05947 152.2
[M]+ 196.08425 149.6
[M]- 196.08535 149.6
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

No patent data available for this compound.