CID 16769788

926189-43-7

Structural Information

Molecular Formula
C9H10N4O
SMILES
CC(C1=CC(=CC=C1)N2C=NN=N2)O
InChI
InChI=1S/C9H10N4O/c1-7(14)8-3-2-4-9(5-8)13-6-10-11-12-13/h2-7,14H,1H3
InChIKey
XLTLXQOIFUIVTF-UHFFFAOYSA-N
Compound name
1-[3-(tetrazol-1-yl)phenyl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.08546 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.092736 140.1
[M+Na]+ 213.074678 149.1
[M-H]- 189.078184 140.7
[M+NH4]+ 208.119283 155.2
[M+K]+ 229.048618 146.0
[M+H-H2O]+ 173.082720 130.9
[M+HCOO]- 235.083661 159.3
[M+CH3COO]- 249.099311 152.2
[M+Na-2H]- 211.060126 145.8
[M]+ 190.08491142 139.6
[M]- 190.08600858 139.6
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.