CID 42032

4-chloro-6-ethyl-alpha-(methylimino)-o-cresol

Structural Information

Molecular Formula
C10H12ClNO
SMILES
CCC1=C(C(=CC(=C1)Cl)C=NC)O
InChI
InChI=1S/C10H12ClNO/c1-3-7-4-9(11)5-8(6-12-2)10(7)13/h4-6,13H,3H2,1-2H3
InChIKey
NSHQJZVHLDYCLF-UHFFFAOYSA-N
Compound name
4-chloro-2-ethyl-6-(methyliminomethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.06075 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.06803 140.1
[M+Na]+ 220.04997 154.2
[M+NH4]+ 215.09457 149.1
[M+K]+ 236.02391 146.4
[M-H]- 196.05347 143.1
[M+Na-2H]- 218.03542 147.2
[M]+ 197.06020 143.3
[M]- 197.06130 143.3
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

No patent data available for this compound.