CID 45382086

(3-cyclopropyl-1h-pyrazol-5-yl)methanol

Structural Information

Molecular Formula
C7H10N2O
SMILES
C1CC1C2=NNC(=C2)CO
InChI
InChI=1S/C7H10N2O/c10-4-6-3-7(9-8-6)5-1-2-5/h3,5,10H,1-2,4H2,(H,8,9)
InChIKey
IOKIHFGBGDBSBB-UHFFFAOYSA-N
Compound name
(3-cyclopropyl-1H-pyrazol-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

138.07932 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.08660 130.2
[M+Na]+ 161.06854 140.5
[M-H]- 137.07204 132.8
[M+NH4]+ 156.11314 145.0
[M+K]+ 177.04248 136.1
[M+H-H2O]+ 121.07658 123.3
[M+HCOO]- 183.07752 151.2
[M+CH3COO]- 197.09317 171.1
[M+Na-2H]- 159.05399 135.5
[M]+ 138.07877 130.3
[M]- 138.07987 130.3
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