CID 71350247

3,5-bis(dimethylamino)phenol

Structural Information

Molecular Formula
C10H16N2O
SMILES
CN(C)C1=CC(=CC(=C1)O)N(C)C
InChI
InChI=1S/C10H16N2O/c1-11(2)8-5-9(12(3)4)7-10(13)6-8/h5-7,13H,1-4H3
InChIKey
VTBZONHGHSXYCH-UHFFFAOYSA-N
Compound name
3,5-bis(dimethylamino)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

180.12627 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.13355 139.7
[M+Na]+ 203.11549 146.8
[M-H]- 179.11899 145.4
[M+NH4]+ 198.16009 160.3
[M+K]+ 219.08943 147.0
[M+H-H2O]+ 163.12353 133.4
[M+HCOO]- 225.12447 165.8
[M+CH3COO]- 239.14012 192.8
[M+Na-2H]- 201.10094 144.5
[M]+ 180.12572 141.3
[M]- 180.12682 141.3
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