CID 140336

2-chloro-5-methoxyphenol

Structural Information

Molecular Formula
C7H7ClO2
SMILES
COC1=CC(=C(C=C1)Cl)O
InChI
InChI=1S/C7H7ClO2/c1-10-5-2-3-6(8)7(9)4-5/h2-4,9H,1H3
InChIKey
KULSVCANYQIOFD-UHFFFAOYSA-N
Compound name
2-chloro-5-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

280
Patents

158.01346 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.02074 126.0
[M+Na]+ 181.00268 140.6
[M+NH4]+ 176.04728 135.4
[M+K]+ 196.97662 133.9
[M-H]- 157.00618 128.2
[M+Na-2H]- 178.98813 133.7
[M]+ 158.01291 129.1
[M]- 158.01401 129.1
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