CID 11845787

{4h,6h,7h-pyrazolo[3,2-c][1,4]oxazin-2-yl}methanol

Structural Information

Molecular Formula
C7H10N2O2
SMILES
C1COCC2=CC(=NN21)CO
InChI
InChI=1S/C7H10N2O2/c10-4-6-3-7-5-11-2-1-9(7)8-6/h3,10H,1-2,4-5H2
InChIKey
BHXIVJNUCBWSFO-UHFFFAOYSA-N
Compound name
6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazin-2-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

154.07423 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.081506 129.5
[M+Na]+ 177.063448 137.6
[M-H]- 153.066954 130.4
[M+NH4]+ 172.108053 148.7
[M+K]+ 193.037388 136.8
[M+H-H2O]+ 137.071490 122.9
[M+HCOO]- 199.072431 147.9
[M+CH3COO]- 213.088081 142.6
[M+Na-2H]- 175.048896 136.8
[M]+ 154.07368142 128.4
[M]- 154.07477858 128.4
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