CID 25247625

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

Structural Information

Molecular Formula
C8H12N2O
SMILES
CN1C(=CC(=N1)C2CC2)CO
InChI
InChI=1S/C8H12N2O/c1-10-7(5-11)4-8(9-10)6-2-3-6/h4,6,11H,2-3,5H2,1H3
InChIKey
XCOCAEQWLWCICR-UHFFFAOYSA-N
Compound name
(3-cyclopropyl-1-methylpyrazol-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

152.09496 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.102236 135.2
[M+Na]+ 175.084178 146.4
[M-H]- 151.087684 139.3
[M+NH4]+ 170.128783 150.4
[M+K]+ 191.058118 142.5
[M+H-H2O]+ 135.092220 128.2
[M+HCOO]- 197.093161 157.3
[M+CH3COO]- 211.108811 177.5
[M+Na-2H]- 173.069626 139.7
[M]+ 152.09441142 137.8
[M]- 152.09550858 137.8
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