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]+ 181.133546 139.7
[M+Na]+ 203.115488 146.8
[M-H]- 179.118994 145.4
[M+NH4]+ 198.160093 160.3
[M+K]+ 219.089428 147.0
[M+H-H2O]+ 163.123530 133.4
[M+HCOO]- 225.124471 165.8
[M+CH3COO]- 239.140121 192.8
[M+Na-2H]- 201.100936 144.5
[M]+ 180.12572142 141.3
[M]- 180.12681858 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