CID 3017616

2-chloro-1-methoxyethanol

Structural Information

Molecular Formula
C3H7ClO2
SMILES
COC(CCl)O
InChI
InChI=1S/C3H7ClO2/c1-6-3(5)2-4/h3,5H,2H2,1H3
InChIKey
WDKOEMMQZYRXJH-UHFFFAOYSA-N
Compound name
2-chloro-1-methoxyethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

110.01346 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.02074 116.7
[M+Na]+ 133.00268 125.2
[M-H]- 109.00618 116.0
[M+NH4]+ 128.04728 139.8
[M+K]+ 148.97662 124.1
[M+H-H2O]+ 93.010720 114.0
[M+HCOO]- 155.01166 135.0
[M+CH3COO]- 169.02731 164.2
[M+Na-2H]- 130.98813 123.3
[M]+ 110.01291 118.9
[M]- 110.01401 118.9
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