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]+ 111.020736 116.7
[M+Na]+ 133.002678 125.2
[M-H]- 109.006184 116.0
[M+NH4]+ 128.047283 139.8
[M+K]+ 148.976618 124.1
[M+H-H2O]+ 93.010720 114.0
[M+HCOO]- 155.011661 135.0
[M+CH3COO]- 169.027311 164.2
[M+Na-2H]- 130.988126 123.3
[M]+ 110.01291142 118.9
[M]- 110.01400858 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