CID 10130062

4-amino-2-(methoxymethyl)phenol

Structural Information

Molecular Formula
C8H11NO2
SMILES
COCC1=C(C=CC(=C1)N)O
InChI
InChI=1S/C8H11NO2/c1-11-5-6-4-7(9)2-3-8(6)10/h2-4,10H,5,9H2,1H3
InChIKey
RGKJLNMYCNSVKZ-UHFFFAOYSA-N
Compound name
4-amino-2-(methoxymethyl)phenol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

6944
Patents

153.07898 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.08626 130.1
[M+Na]+ 176.06820 138.5
[M-H]- 152.07170 132.5
[M+NH4]+ 171.11280 150.5
[M+K]+ 192.04214 136.5
[M+H-H2O]+ 136.07624 124.7
[M+HCOO]- 198.07718 154.3
[M+CH3COO]- 212.09283 176.2
[M+Na-2H]- 174.05365 136.1
[M]+ 153.07843 129.6
[M]- 153.07953 129.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe